data_5ttb_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5ttb _Structure_validation_residue.Date_analyzed 2017-05-05 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 t0 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 107.676 -1.231 . . . . 72.13 107.676 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.44 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 17.5 m120 -142.96 108.95 5.19 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 112.071 0.397 . . . . 61.52 112.071 -171.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 93' ' ' GLU . 0.4 OUTLIER -111.64 -76.81 0.59 Allowed 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.109 -1.071 . . . . 74.1 108.109 173.702 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 93' ' ' GLU . 14.3 t-80 -79.31 -32.95 43.57 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 105.409 -2.071 . . . . 70.34 105.409 169.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 15' ' ' ASN . . . -52.26 -14.29 0.43 Allowed 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 111.979 -2.373 . . . . 75.13 111.946 173.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.17 -21.78 0.54 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.769 0.828 . . . . 73.42 112.122 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.77 -45.44 74.25 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 108.509 -0.923 . . . . 73.14 108.509 171.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.506 ' CE1' HD23 ' A' ' 24' ' ' LEU . 82.4 t80 -59.85 -25.32 64.93 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.616 -0.72 . . . . 74.41 111.072 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -62.4 -41.29 98.55 Favored 'General case' 0 C--O 1.191 -2.003 0 N-CA-C 108.584 -0.895 . . . . 72.13 108.584 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -66.11 -33.01 74.82 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 123.347 0.404 . . . . 74.12 111.974 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.567 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 4.6 tt -61.93 -37.49 84.87 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 108.44 -0.948 . . . . 73.44 108.44 173.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -84.46 -37.59 21.18 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.012 -0.995 . . . . 75.24 111.802 -173.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -58.11 -40.03 80.14 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.367 -0.833 . . . . 72.34 109.224 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -72.24 -42.92 65.1 Favored 'General case' 0 N--CA 1.432 -1.337 0 C-N-CA 120.498 -0.481 . . . . 74.31 110.408 172.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.2 tt -51.0 -35.58 34.78 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.335 1.054 . . . . 75.13 112.404 -177.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -58.29 -51.32 72.68 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 CA-C-O 120.616 0.246 . . . . 74.51 111.239 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.2 -19.14 43.92 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.586 -0.445 . . . . 72.01 112.068 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -55.28 -53.38 56.8 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.43 0.692 . . . . 73.22 110.63 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.0 mt -97.53 -0.6 45.66 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 119.379 -0.929 . . . . 73.54 111.174 174.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 t30 61.15 69.66 0.65 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.476 1.132 . . . . 74.11 108.745 -172.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 mt -103.86 150.98 23.65 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.287 -1.324 . . . . 74.44 109.65 -176.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 m -83.93 147.79 52.29 Favored Pre-proline 0 C--N 1.289 -2.04 0 N-CA-C 106.9 -1.519 . . . . 73.5 106.9 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -55.14 -29.4 65.89 Favored 'Trans proline' 0 N--CA 1.487 1.11 0 C-N-CA 121.943 1.762 . . . . 73.35 112.426 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.71 -0.18 37.23 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 121.107 0.479 . . . . 71.23 110.48 177.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -116.39 -4.82 11.78 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 107.932 -1.136 . . . . 71.03 107.932 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -142.84 78.44 1.61 Allowed 'General case' 0 N--CA 1.421 -1.901 0 CA-C-O 122.227 1.013 . . . . 75.42 111.161 -175.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.419 ' O ' HD11 ' A' ' 80' ' ' LEU . 30.0 t-80 -120.94 165.46 15.2 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 104.093 -2.558 . . . . 71.55 104.093 169.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.439 ' HA ' ' HB2' ' A' ' 80' ' ' LEU 0.464 8.0 pt-20 -60.36 -16.68 37.42 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 117.897 2.555 . . . . 73.2 117.897 -171.724 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.16 -11.2 33.35 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.675 0.67 . . . . 74.15 109.908 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 m -64.46 136.62 57.26 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-N 115.571 -0.74 . . . . 73.35 110.422 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.432 ' HB2' ' CB ' ' A' ' 47' ' ' GLN . 0.8 OUTLIER -81.87 126.74 32.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.313 0.578 . . . . 74.24 110.68 -176.385 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.5 mt -77.56 -35.54 53.04 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 113.976 1.102 . . . . 72.35 113.976 -176.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.42 HG12 ' CB ' ' A' ' 78' ' ' PRO . 48.2 mm -71.49 -26.55 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 108.304 -0.999 . . . . 73.21 108.304 175.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.432 ' CB ' ' HB2' ' A' ' 44' ' ' ASN . 53.2 tt0 -69.48 -32.74 71.84 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.617 -1.174 . . . . 75.3 109.336 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.31 -13.36 55.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.416 -0.811 . . . . 74.21 110.879 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.46 35.45 6.95 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.998 -0.62 . . . . 72.42 113.499 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.6 tp -74.24 106.41 5.87 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.585 -0.894 . . . . 74.14 108.585 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.577 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 3.7 p30 -64.24 163.35 12.95 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.069 -0.969 . . . . 72.31 110.673 -178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.42 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 19.8 m -74.74 -14.08 60.68 Favored 'General case' 0 N--CA 1.416 -2.163 0 N-CA-C 114.125 1.158 . . . . 73.51 114.125 -176.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.615 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 46.3 mm -73.42 -42.55 56.7 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.354 0 N-CA-C 106.704 -1.591 . . . . 75.22 106.704 175.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.577 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 3.4 mpt_? -56.63 -47.03 80.58 Favored 'General case' 0 CA--C 1.507 -0.702 0 O-C-N 123.545 0.528 . . . . 73.25 109.662 174.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 51' ' ' ASP . 65.6 mt -53.22 -47.0 69.34 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.083 -0.962 . . . . 74.34 110.831 177.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 66.7 mtt -81.11 -19.06 44.42 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.546 0.573 . . . . 75.34 112.546 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.615 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 4.1 mmp_? -73.97 -42.0 61.12 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.44 0.638 . . . . 75.21 109.351 177.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.567 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 8.8 m95 -64.64 -28.36 69.56 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.436 -1.257 . . . . 72.52 113.781 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.87 -39.08 73.67 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 120.969 0.414 . . . . 74.11 110.896 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -69.52 -32.44 71.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.012 -0.54 . . . . 74.02 109.937 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.502 ' CE3' ' HB2' ' A' ' 24' ' ' LEU . 2.7 t90 -72.62 -29.96 63.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.472 -0.785 . . . . 74.12 110.044 -175.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.418 ' CD2' HD12 ' A' ' 69' ' ' LEU . 64.2 m-85 -73.12 -53.29 11.4 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-O 121.747 0.784 . . . . 73.53 110.516 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -64.92 -14.85 61.07 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.851 -1.068 . . . . 74.52 111.062 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -48.9 -46.82 43.39 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.334 1.854 . . . . 73.2 111.85 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.486 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 3.5 m-20 -104.67 14.47 29.72 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-O 121.611 0.719 . . . . 72.12 109.221 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.83 16.98 76.09 Favored Glycine 0 N--CA 1.417 -2.574 0 CA-C-N 115.298 -0.865 . . . . 73.25 112.423 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.486 ' CE1' ' HB2' ' A' ' 65' ' ' ASN . 43.1 m-85 -63.22 159.91 16.73 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 117.524 0.662 . . . . 75.44 110.126 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -125.94 91.88 3.48 Favored 'General case' 0 C--N 1.285 -2.199 0 C-N-CA 117.856 -1.538 . . . . 74.31 112.982 -160.104 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.418 HD12 ' CD2' ' A' ' 62' ' ' PHE . 3.7 pp -158.1 165.61 34.57 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 119.708 -0.797 . . . . 75.43 111.667 176.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.7 p -120.72 144.67 48.11 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.258 -1.016 . . . . 74.41 108.258 176.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 33.8 tp -62.04 -25.17 67.52 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.037 0.754 . . . . 74.14 113.037 -174.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 19.5 ptt180 -56.34 -25.82 50.47 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 121.43 0.633 . . . . 74.11 109.464 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -86.09 -23.16 26.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.143 -0.935 . . . . 73.3 109.817 -173.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.505 HD22 ' CG ' ' A' ' 83' ' ' TRP . 19.3 mt -83.41 -24.55 31.87 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.009 -0.996 . . . . 74.55 109.31 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -78.68 -42.77 27.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.333 -0.848 . . . . 73.2 109.653 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.89 -47.01 87.51 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.543 -0.753 . . . . 74.2 111.38 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.75 87.27 56.88 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 108.536 -0.913 . . . . 70.5 108.536 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.42 ' CB ' HG12 ' A' ' 46' ' ' ILE . 58.9 Cg_endo -85.83 85.82 1.05 Allowed 'Trans proline' 0 N--CA 1.422 -2.721 0 C-N-CA 120.658 0.906 . . . . 74.45 112.756 -175.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.5 p -151.29 144.06 24.42 Favored 'General case' 0 C--N 1.288 -2.067 0 N-CA-C 105.806 -1.924 . . . . 73.22 105.806 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 41' ' ' GLU . 52.4 mt -52.92 -45.81 67.78 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 123.771 0.67 . . . . 75.22 110.698 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.88 -43.8 39.38 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 114.427 -1.26 . . . . 74.23 112.05 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.5 -51.96 63.33 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.765 -0.374 . . . . 73.15 110.826 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.505 ' CG ' HD22 ' A' ' 74' ' ' LEU . 3.3 m0 -60.19 -36.68 78.18 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 122.031 0.92 . . . . 75.1 108.734 -176.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -71.41 -51.26 24.98 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.449 -1.251 . . . . 75.44 111.54 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -71.23 -18.82 62.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 112.095 0.406 . . . . 75.55 112.095 -176.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 92.6 mt -63.02 -19.05 63.99 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.91 0.386 . . . . 74.5 110.792 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 62.6 mtt -77.17 -61.51 1.96 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.597 -0.89 . . . . 73.23 108.597 173.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.404 ' H ' HD23 ' A' ' 88' ' ' LEU . 2.4 mm? -62.98 -31.34 72.44 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.751 1.019 . . . . 72.14 113.751 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.2 t -79.78 -5.62 55.69 Favored 'General case' 0 C--N 1.311 -1.106 0 O-C-N 121.904 -0.498 . . . . 72.44 111.943 -175.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -115.54 -1.22 12.82 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.251 0.548 . . . . 75.24 111.62 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.8 p 179.71 118.37 0.21 Allowed Pre-proline 0 N--CA 1.432 -1.328 0 N-CA-C 106.319 -1.734 . . . . 45.23 106.319 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.77 117.43 4.76 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 120.954 1.103 . . . . 72.03 110.514 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.544 ' HB3' ' HB3' ' A' ' 17' ' ' HIS . 27.7 mt-10 . . . . . 0 C--O 1.27 2.141 0 N-CA-C 107.321 -1.363 . . . . 65.32 107.321 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 . . . . . 0 C--O 1.214 -0.81 0 N-CA-C 108.646 -0.872 . . . . 73.54 108.646 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 45.51 37.35 3.03 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 125.279 1.432 . . . . 74.11 113.846 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -48.24 78.88 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.734 1.013 . . . . 72.12 113.734 -176.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -77.8 -39.19 44.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.752 0.787 . . . . 74.42 110.049 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.466 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -64.8 -15.56 61.87 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.475 -1.239 . . . . 71.53 113.705 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -53.27 -38.61 63.22 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.2 0.2 . . . . 75.33 111.175 174.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 38.5 t70 -76.63 -26.29 54.74 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 109.092 -0.707 . . . . 73.31 109.092 177.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.503 ' CE2' HD23 ' A' ' 24' ' ' LEU . 65.6 t80 -63.9 -22.78 67.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.266 -0.425 . . . . 75.13 110.133 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -60.08 -36.58 77.69 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.291 -0.633 . . . . 74.14 109.291 176.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.419 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 5.7 tt0 -64.34 -42.56 96.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.601 -0.727 . . . . 73.1 109.47 176.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.503 HD23 ' CE2' ' A' ' 21' ' ' TYR . 5.9 tt -66.1 -40.07 90.48 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.693 -0.484 . . . . 72.23 109.693 177.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.43 ' CD ' HD23 ' A' ' 80' ' ' LEU . 2.7 tpp85 -60.79 -48.1 83.32 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.147 -0.686 . . . . 74.41 109.147 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.414 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 28.6 tt0 -49.76 -48.94 50.01 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.698 1.599 . . . . 70.24 110.159 177.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.476 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 89.0 mtt180 -81.94 -18.44 43.55 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 113.86 1.059 . . . . 74.44 113.86 -173.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 28.0 mt -70.92 -38.16 72.93 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 120.277 -0.569 . . . . 74.32 110.059 171.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 34' ' ' LEU . 62.2 mt -62.81 -39.95 86.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 107.842 -1.17 . . . . 72.35 107.842 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -61.9 -59.34 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 114.762 -1.108 . . . . 74.21 111.654 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 27' ' ' ARG . 50.3 mt-10 -55.6 -54.45 43.96 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 113.906 1.076 . . . . 74.23 113.906 -173.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.421 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 88.3 mt -97.17 6.65 48.11 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.012 -1.075 . . . . 72.22 113.042 -174.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 54.36 45.03 28.01 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 122.86 1.314 . . . . 63.41 108.914 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.429 ' O ' HG22 ' A' ' 29' ' ' ILE . 37.6 mt -79.33 129.96 34.98 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 114.479 -1.237 . . . . 72.45 108.66 -175.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.8 m -70.82 141.95 87.71 Favored Pre-proline 0 N--CA 1.421 -1.896 0 N-CA-C 106.069 -1.826 . . . . 74.51 106.069 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.52 -30.1 52.7 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.284 1.99 . . . . 73.52 112.606 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 -68.35 -25.02 64.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.201 -0.454 . . . . 72.21 110.94 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' SER . 49.4 tt0 -89.57 -38.96 13.59 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.718 -0.845 . . . . 73.0 108.718 177.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.451 ' CD1' HD11 ' A' ' 80' ' ' LEU . 1.7 tm? -88.06 65.28 8.13 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-O 123.018 1.39 . . . . 73.52 110.262 -175.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.448 ' O ' HD13 ' A' ' 80' ' ' LEU . 11.7 t-160 -96.68 164.14 12.71 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 112.892 -1.958 . . . . 72.05 106.381 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -51.53 -29.91 18.55 Favored 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 122.101 0.953 . . . . 74.22 110.906 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -80.26 -10.05 59.75 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 127.731 2.412 . . . . 75.55 112.795 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.543 ' O ' ' HA ' ' A' ' 79' ' ' THR . 54.1 p -64.59 119.2 10.04 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 112.899 0.703 . . . . 74.41 112.899 -176.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.5 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 42.8 t-20 -73.92 105.26 5.1 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.25 -1.018 . . . . 75.42 108.25 174.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 76.7 mt -70.32 -23.02 62.77 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 114.822 1.416 . . . . 72.43 114.822 -174.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.408 HG12 ' CB ' ' A' ' 78' ' ' PRO . 46.0 mm -73.53 -39.87 54.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.539 -0.911 . . . . 74.21 108.539 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -77.37 -18.08 57.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.185 -0.916 . . . . 71.24 110.052 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.5 -27.27 55.97 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.17 -0.678 . . . . 75.51 109.17 175.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.65 38.46 0.91 Allowed Glycine 0 N--CA 1.434 -1.473 0 C-N-CA 120.511 -0.852 . . . . 64.52 115.103 175.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.49 ' CD1' ' HB3' ' A' ' 45' ' ' LEU . 34.4 mt -89.21 103.25 15.89 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.385 -0.969 . . . . 75.25 108.385 173.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.582 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 4.0 p30 -67.8 159.04 31.1 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.624 -0.88 . . . . 74.23 108.624 177.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.5 m -66.57 -17.98 65.12 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.52 1.304 . . . . 60.04 114.52 -175.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 51.5 mm -77.12 -48.23 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.808 0 C-N-CA 117.821 -1.552 . . . . 75.23 107.909 178.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.582 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 29.2 mtp180 -65.54 -35.05 79.7 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 123.904 0.752 . . . . 73.41 110.755 177.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.43 HD22 ' CZ ' ' A' ' 75' ' ' TYR . 14.3 tp -57.88 -44.18 86.51 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.393 -0.965 . . . . 72.41 108.393 175.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 53.5 ttm -81.22 -20.28 41.41 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.26 -0.882 . . . . 71.14 111.125 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 5.4 mmp_? -65.37 -40.59 93.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.73 -1.211 . . . . 74.55 107.73 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -62.53 -33.14 74.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.12 -1.4 . . . . 74.13 111.801 176.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.9 tp -57.11 -43.52 82.36 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 120.741 0.305 . . . . 71.15 110.576 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -67.23 -36.54 81.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.315 0.579 . . . . 73.42 109.612 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.627 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 70.8 t90 -64.25 -36.61 84.64 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.136 -0.938 . . . . 73.31 110.259 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.51 ' CD1' HD11 ' A' ' 69' ' ' LEU . 49.7 m-85 -70.38 -58.23 3.97 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.454 0.645 . . . . 70.34 111.453 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.432 ' NH2' ' HA ' ' A' ' 68' ' ' ARG . 0.9 OUTLIER -65.01 -16.1 63.06 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.251 -0.886 . . . . 73.13 112.085 -172.693 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.8 pttm -56.27 -39.59 72.88 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.932 0.493 . . . . 75.22 111.608 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.455 ' HB3' ' CE1' ' A' ' 67' ' ' TYR . 66.1 t30 -114.93 24.79 11.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 122.33 1.062 . . . . 73.21 108.285 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.37 26.17 73.94 Favored Glycine 0 N--CA 1.437 -1.249 0 CA-C-N 114.432 -1.258 . . . . 63.2 114.159 177.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 65' ' ' ASN . 60.9 m-85 -69.98 142.33 52.85 Favored 'General case' 0 CA--C 1.475 -1.906 0 CA-C-N 118.072 0.936 . . . . 74.1 110.394 177.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.533 ' NH1' ' HA ' ' A' ' 69' ' ' LEU . 0.0 OUTLIER -98.32 91.54 5.27 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 114.971 -1.013 . . . . 74.55 112.196 -163.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.533 ' HA ' ' NH1' ' A' ' 68' ' ' ARG . 4.5 pp -168.28 148.9 4.86 Favored 'General case' 0 CA--C 1.486 -1.484 0 O-C-N 123.928 0.768 . . . . 71.45 111.22 168.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.576 ' HB ' ' OE1' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -103.75 168.71 8.96 Favored 'General case' 0 N--CA 1.399 -3.009 0 N-CA-C 103.74 -2.689 . . . . 73.43 103.74 171.426 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.463 HD11 HD12 ' A' ' 74' ' ' LEU . 14.0 tp -79.28 -23.75 43.38 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 119.317 -0.953 . . . . 75.45 112.176 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 24.6 tpt85 -60.34 -27.72 67.58 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 120.696 0.284 . . . . 75.51 110.402 -178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.576 ' OE1' ' HB ' ' A' ' 70' ' ' THR . 2.6 mp0 -71.94 -40.01 69.02 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.976 0.894 . . . . 75.44 109.849 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.463 HD12 HD11 ' A' ' 71' ' ' LEU . 15.8 mt -67.81 -27.94 67.15 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.22 -1.355 . . . . 75.14 110.636 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.43 ' CZ ' HD22 ' A' ' 55' ' ' LEU . 54.8 m-85 -84.0 -3.64 58.15 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.014 -0.539 . . . . 74.2 110.819 173.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.93 -49.32 5.35 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.173 -0.677 . . . . 75.32 109.173 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.96 88.72 53.79 Favored Pre-proline 0 N--CA 1.429 -1.496 0 N-CA-C 108.334 -0.987 . . . . 72.24 108.334 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.5 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 10.8 Cg_endo -88.27 86.59 0.58 Allowed 'Trans proline' 0 N--CA 1.423 -2.625 0 C-N-CA 121.139 1.226 . . . . 73.23 112.516 -177.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.543 ' HA ' ' O ' ' A' ' 43' ' ' SER . 13.7 p -151.5 151.02 31.05 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 105.935 -1.876 . . . . 62.33 105.935 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.451 HD11 ' CD1' ' A' ' 39' ' ' LEU . 89.7 mt -50.45 -48.5 56.42 Favored 'General case' 0 CA--C 1.5 -0.964 0 O-C-N 123.647 0.592 . . . . 75.32 110.977 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 85' ' ' GLN . . . -44.82 -46.9 10.92 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 113.594 -1.639 . . . . 71.35 112.144 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.563 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -64.81 -53.03 53.32 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-O 119.242 -0.408 . . . . 73.12 111.819 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.468 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -62.7 -34.95 78.2 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 108.326 -0.99 . . . . 74.51 108.326 -175.571 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -65.89 -51.65 56.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.311 -1.313 . . . . 72.43 110.605 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 81' ' ' ALA . 78.7 mt-30 -72.37 -29.64 63.96 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 116.109 -0.496 . . . . 74.04 111.486 -178.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 81.6 mt -56.68 -28.09 60.09 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.213 0.449 . . . . 75.01 112.213 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.466 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 55.3 mtt -68.31 -54.99 13.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.648 -0.501 . . . . 75.31 109.648 174.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.94 -46.11 46.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.398 1.259 . . . . 73.41 114.398 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 m -73.35 2.55 7.34 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.767 0.794 . . . . 75.44 111.768 -175.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.611 ' O ' ' HD2' ' A' ' 92' ' ' PRO . 1.4 mmp_? -120.92 -66.11 1.08 Allowed 'General case' 0 N--CA 1.418 -2.038 0 CA-C-N 115.614 -0.721 . . . . 71.3 112.069 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.408 ' HB2' ' CD ' ' A' ' 92' ' ' PRO 0.254 12.2 m 64.69 -84.3 0.0 OUTLIER Pre-proline 0 CA--C 1.596 2.721 0 CA-C-O 117.675 -1.155 . . . . 74.52 110.936 -167.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.611 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 73.0 Cg_endo -79.32 167.64 21.11 Favored 'Trans proline' 0 C--N 1.399 3.231 0 CA-C-N 123.211 2.183 . . . . 74.03 110.016 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.413 ' HA ' ' CD ' ' A' ' 68' ' ' ARG . 11.3 mm-40 . . . . . 0 C--O 1.263 1.792 0 C-N-CA 123.993 0.917 . . . . 74.42 112.672 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 p30 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 112.859 0.689 . . . . 71.03 112.859 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.404 ' HA ' ' HB1' ' A' ' 18' ' ' ALA . 20.1 m-80 -137.05 21.82 3.02 Favored 'General case' 0 C--O 1.206 -1.22 0 N-CA-C 115.901 1.815 . . . . 70.53 115.901 -174.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.497 ' HD2' ' H ' ' A' ' 16' ' ' ARG 0.425 0.1 OUTLIER -65.71 -74.7 0.1 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.532 -2.067 . . . . 74.4 113.999 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.429 ' H ' ' HG2' ' A' ' 16' ' ' ARG . 64.4 m-70 -78.91 -21.97 46.56 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 121.134 -0.979 . . . . 74.34 110.007 173.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.435 ' N ' HD21 ' A' ' 88' ' ' LEU . . . -69.54 -15.86 63.31 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 114.47 -1.241 . . . . 74.44 112.572 -177.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.94 60.0 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.119 0.485 . . . . 74.34 110.166 174.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.49 -34.73 78.94 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.697 -0.683 . . . . 73.13 109.431 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.515 ' CE1' HD22 ' A' ' 24' ' ' LEU . 91.1 t80 -63.3 -30.14 71.33 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.151 -0.477 . . . . 70.22 110.402 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.429 ' OE1' ' HD3' ' A' ' 25' ' ' ARG . 2.7 mp0 -67.27 -22.85 65.64 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 120.863 0.363 . . . . 74.43 111.7 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -78.14 -24.55 47.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.272 0.558 . . . . 73.3 110.428 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.665 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 2.0 tt -74.45 -48.99 24.14 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.453 -1.314 . . . . 73.24 107.453 171.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.429 ' HD3' ' OE1' ' A' ' 22' ' ' GLN . 27.7 ttt180 -57.45 -39.87 77.22 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.974 1.309 . . . . 73.0 114.043 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -50.43 -49.11 55.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.121 0.962 . . . . 74.43 108.812 176.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.85 -17.89 32.26 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 114.687 -1.142 . . . . 72.41 112.706 -177.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.421 HD12 ' CD2' ' A' ' 24' ' ' LEU . 1.2 tt -63.05 -42.79 99.8 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 108.752 -0.833 . . . . 74.44 108.752 174.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.1 mt -68.15 -27.61 37.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 114.78 -1.1 . . . . 73.15 110.023 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -74.92 -50.82 15.53 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.275 -0.875 . . . . 74.0 110.841 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.265 43.6 mt-10 -62.11 -29.12 70.11 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 116.229 1.937 . . . . 74.42 116.229 -174.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.424 HD11 HD12 ' A' ' 34' ' ' LEU . 46.0 mt -99.52 -4.06 32.07 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 118.435 -1.306 . . . . 73.43 112.255 170.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 t30 58.46 69.1 0.76 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.497 1.141 . . . . 74.4 108.388 -172.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.424 HD12 HD11 ' A' ' 32' ' ' LEU . 17.8 mt -109.13 163.09 13.65 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.133 -1.394 . . . . 74.12 109.666 -174.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 37.4 p -113.0 156.81 42.21 Favored Pre-proline 0 C--N 1.287 -2.112 0 N-CA-C 107.693 -1.225 . . . . 75.45 107.693 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -62.67 -17.29 58.03 Favored 'Trans proline' 0 N--CA 1.485 0.983 0 C-N-CA 122.397 2.064 . . . . 74.41 113.127 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -87.0 -29.99 21.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.232 0.539 . . . . 75.3 109.568 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -79.54 -48.11 14.39 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 108.722 -0.844 . . . . 72.45 108.722 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.02 76.83 1.95 Allowed 'General case' 0 N--CA 1.407 -2.581 0 N-CA-C 108.797 -0.816 . . . . 71.41 108.797 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -74.02 151.78 40.16 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 105.597 -2.001 . . . . 74.33 105.597 170.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.479 ' HA ' HD13 ' A' ' 80' ' ' LEU 0.354 5.1 pt-20 -68.37 -14.29 62.89 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 115.972 1.841 . . . . 74.15 115.972 -173.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -112.12 23.57 13.57 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.326 1.06 . . . . 72.15 108.423 174.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 29.9 t -91.9 151.44 20.53 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.056 -1.091 . . . . 62.23 108.056 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.495 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 19.2 t-20 -78.37 111.76 14.69 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.213 0.53 . . . . 75.31 111.398 -174.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.414 ' HB3' HD12 ' A' ' 50' ' ' LEU . 20.8 mt -66.24 -26.39 67.34 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 114.346 1.239 . . . . 75.33 114.346 -178.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.7 mm -72.42 -40.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.16 -0.616 . . . . 75.22 109.364 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -74.96 -16.43 60.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 72.55 110.311 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.61 -20.68 59.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.861 -0.792 . . . . 61.04 108.861 174.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.17 22.61 6.44 Favored Glycine 0 N--CA 1.43 -1.707 0 N-CA-C 115.251 0.861 . . . . 70.14 115.251 174.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.414 HD12 ' HB3' ' A' ' 45' ' ' LEU . 57.8 mt -69.67 110.31 4.8 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 118.213 1.006 . . . . 74.33 111.094 176.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -75.07 169.24 18.4 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 107.896 -1.15 . . . . 73.45 107.896 174.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -73.36 -14.41 61.28 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 114.854 1.427 . . . . 74.13 114.854 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 50.7 mm -80.34 -46.36 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.193 0 N-CA-C 106.792 -1.558 . . . . 72.3 106.792 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.475 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 61.8 mtm180 -66.24 -20.75 66.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 121.307 0.575 . . . . 72.04 111.959 175.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.7 tp -78.58 -42.2 29.78 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.544 -0.91 . . . . 75.14 108.544 175.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.5 ttm -80.16 -18.77 48.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.878 -0.601 . . . . 74.13 110.094 -175.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.475 ' HG3' ' HA ' ' A' ' 54' ' ' ARG . 7.5 mmm180 -47.26 -43.24 21.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.136 1.375 . . . . 74.32 109.712 172.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.665 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 32.7 m95 -83.82 -26.05 29.85 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 113.878 -1.51 . . . . 70.2 113.856 -176.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.6 -42.25 74.58 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.919 0.39 . . . . 74.35 111.207 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -81.14 -26.53 36.02 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.15 0.5 . . . . 72.5 109.798 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.45 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 39.9 t90 -66.79 -42.57 85.77 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.74 -0.663 . . . . 75.14 109.679 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.463 ' CE2' HD23 ' A' ' 69' ' ' LEU . 64.7 m-85 -57.58 -48.78 78.44 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.352 1.073 . . . . 71.3 110.533 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -69.97 -12.83 61.9 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 114.336 -1.302 . . . . 73.24 113.842 -172.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -58.78 -30.02 67.24 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 120.834 0.349 . . . . 72.45 110.649 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.36 8.18 35.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 109.433 -0.58 . . . . 71.1 109.433 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.65 30.87 51.88 Favored Glycine 0 N--CA 1.433 -1.543 0 C-N-CA 120.664 -0.779 . . . . 61.44 111.522 -175.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . 0.272 28.1 m-85 -74.65 165.2 25.6 Favored 'General case' 0 CA--C 1.487 -1.469 0 C-N-CA 119.383 -0.927 . . . . 74.31 112.34 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -124.12 94.97 4.38 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 118.994 -1.083 . . . . 75.11 112.976 -160.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.463 HD23 ' CE2' ' A' ' 62' ' ' PHE . 3.4 pp -167.88 163.42 13.91 Favored 'General case' 0 C--O 1.256 1.413 0 N-CA-C 112.741 0.645 . . . . 72.34 112.741 171.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 77.7 p -112.77 154.5 26.11 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 106.208 -1.775 . . . . 63.3 106.208 171.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.461 HD11 HD11 ' A' ' 74' ' ' LEU . 19.2 tp -72.5 -23.98 61.1 Favored 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 120.678 -0.409 . . . . 71.51 111.058 -176.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -65.53 -19.86 66.1 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-O 120.833 0.349 . . . . 74.52 110.557 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -78.08 -31.42 50.13 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.047 0.927 . . . . 70.11 108.849 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.461 HD11 HD11 ' A' ' 71' ' ' LEU . 65.9 mt -77.6 -17.02 58.23 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.971 -1.468 . . . . 75.33 111.757 -176.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -81.18 -37.22 29.08 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.127 -0.694 . . . . 75.2 109.127 172.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.65 -46.69 62.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.307 -0.86 . . . . 73.55 110.656 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.11 83.08 56.23 Favored Pre-proline 0 N--CA 1.434 -1.26 0 N-CA-C 109.154 -0.684 . . . . 74.22 109.154 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.495 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 15.3 Cg_endo -95.27 86.7 0.11 Allowed 'Trans proline' 0 N--CA 1.417 -2.979 0 C-N-CA 121.337 1.358 . . . . 52.14 112.656 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 50.0 p -146.69 149.25 33.08 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 104.967 -2.234 . . . . 72.32 104.967 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.479 HD13 ' HA ' ' A' ' 41' ' ' GLU . 81.7 mt -53.76 -43.54 69.27 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 118.43 0.559 . . . . 73.43 111.808 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -57.39 -43.23 83.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.18 -0.918 . . . . 51.55 111.546 -179.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.519 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.63 -48.05 78.85 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.79 -0.186 . . . . 73.22 111.438 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.495 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 5.8 m0 -62.05 -38.0 87.11 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.017 -0.735 . . . . 75.22 109.017 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.83 -54.8 37.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.85 -1.068 . . . . 61.14 110.093 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -69.45 -29.23 66.88 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 115.563 -0.744 . . . . 74.22 112.802 -177.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 67.8 mt -59.08 -18.81 38.57 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.02 0.827 . . . . 74.23 112.933 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.8 mtt -73.97 -57.46 3.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.448 0.642 . . . . 74.14 109.277 172.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.569 ' HB3' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm? -88.87 -31.4 18.28 Favored 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 116.619 2.081 . . . . 73.43 116.619 -170.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.0 p -64.37 -5.32 4.99 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 119.5 1.046 . . . . 73.11 113.658 -174.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 mtt-85 -95.6 5.78 50.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.052 -1.092 . . . . 74.21 108.052 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.8 m -150.29 -161.37 0.05 OUTLIER Pre-proline 0 CA--C 1.569 1.685 0 N-CA-C 104.138 -2.542 . . . . 65.34 104.138 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -62.37 118.85 5.75 Favored 'Trans proline' 0 C--N 1.366 1.468 0 CA-C-N 122.771 2.026 . . . . 73.25 110.207 170.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 88' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.428 0 O-C-N 123.875 0.735 . . . . 70.13 109.241 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 . . . . . 0 C--O 1.213 -0.827 0 N-CA-C 107.47 -1.307 . . . . 71.05 107.47 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -153.58 126.5 8.34 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.758 -0.777 . . . . 71.04 112.947 -173.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.293 0.0 OUTLIER -110.08 -75.82 0.62 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.481 0.548 . . . . 74.31 112.481 175.568 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -79.19 -30.84 43.62 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 104.688 -2.338 . . . . 72.14 104.688 169.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.27 -13.97 0.14 Allowed 'General case' 0 C--O 1.197 -1.674 0 CA-C-N 112.578 -2.101 . . . . 64.41 112.372 169.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.54 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -45.04 -22.02 0.08 Allowed 'General case' 0 C--O 1.199 -1.585 0 C-N-CA 123.906 0.882 . . . . 71.31 112.854 175.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.569 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 25.2 t70 -51.61 -42.39 61.93 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.121 -0.696 . . . . 64.44 109.121 170.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.689 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 75.1 t80 -59.12 -24.29 62.86 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 123.916 0.886 . . . . 75.14 110.71 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.54 ' HB2' ' O ' ' A' ' 19' ' ' ALA . 4.6 mm100 -57.91 -43.92 86.48 Favored 'General case' 0 C--O 1.189 -2.119 0 C-N-CA 120.354 -0.538 . . . . 73.3 112.206 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . 0.292 26.6 mp0 -72.46 -19.67 61.52 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.144 0.794 . . . . 73.51 113.144 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.534 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 5.0 tt -73.69 -32.61 64.04 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.659 -1.237 . . . . 73.42 107.659 170.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.2 ttp180 -83.26 -45.04 14.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.076 -0.966 . . . . 75.05 110.718 -173.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -60.88 -34.45 74.66 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 114.744 -1.116 . . . . 74.15 109.465 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.6 ttt85 -73.02 -42.14 63.51 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 119.393 -0.923 . . . . 73.34 110.357 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.6 mt -52.77 -36.73 58.45 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.489 0.922 . . . . 74.51 113.489 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.409 HG23 ' O ' ' A' ' 34' ' ' LEU . 61.0 mt -57.66 -45.3 86.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 O-C-N 123.728 0.643 . . . . 54.34 110.514 176.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -82.27 -34.6 28.67 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.909 -0.495 . . . . 72.0 111.338 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -49.51 -49.98 43.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.075 1.35 . . . . 73.35 111.715 -175.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 96.4 mt -110.91 11.41 22.3 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.252 -0.579 . . . . 74.52 112.034 176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.73 37.77 22.01 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.844 0.831 . . . . 71.03 111.146 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.409 ' O ' HG23 ' A' ' 29' ' ' ILE . 29.5 mt -80.31 129.48 34.53 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 108.171 -1.048 . . . . 75.31 108.171 -177.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -71.06 145.96 92.09 Favored Pre-proline 0 C--N 1.297 -1.691 0 N-CA-C 107.131 -1.433 . . . . 62.14 107.131 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -57.76 -16.25 24.47 Favored 'Trans proline' 0 N--CA 1.494 1.545 0 C-N-CA 122.508 2.138 . . . . 75.41 112.665 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -78.02 -23.14 48.33 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-O 121.272 0.558 . . . . 75.21 109.669 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -95.41 -43.64 7.91 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 108.791 -0.818 . . . . 74.44 108.791 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.417 ' CD1' HD12 ' A' ' 80' ' ' LEU . 2.4 tm? -85.75 76.74 9.89 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.463 1.125 . . . . 74.33 110.068 -175.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.535 ' O ' HD11 ' A' ' 80' ' ' LEU . 48.0 t-80 -112.67 164.75 12.97 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 105.395 -2.076 . . . . 73.31 105.395 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -46.89 -48.95 21.06 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 119.287 0.948 . . . . 72.34 111.321 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -80.1 24.25 0.43 Allowed 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.377 1.471 . . . . 71.54 113.864 -177.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.625 ' O ' ' HA ' ' A' ' 79' ' ' THR . 37.4 p -85.42 130.82 34.5 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 121.417 -0.802 . . . . 62.44 111.118 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.491 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 48.1 t-20 -78.96 100.67 7.38 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.97 -0.752 . . . . 70.12 108.97 177.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.451 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 82.3 mt -68.29 -17.3 64.24 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 114.42 1.267 . . . . 74.32 114.42 -175.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.9 mm -78.71 -34.16 17.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.83 -0.804 . . . . 75.05 108.83 177.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -77.89 -22.99 48.92 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.429 -0.805 . . . . 71.12 109.68 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.09 -27.53 62.72 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.254 -0.885 . . . . 55.4 109.684 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.33 32.22 2.83 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.51 -0.852 . . . . 70.11 115.218 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.451 ' CD1' ' HB3' ' A' ' 45' ' ' LEU . 76.5 mt -76.38 104.24 6.8 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 118.006 0.903 . . . . 73.32 110.374 174.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -64.34 158.84 22.46 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 107.966 -1.124 . . . . 74.34 107.966 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.8 m -65.62 -24.68 67.11 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 114.183 1.179 . . . . 74.14 114.183 -172.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.687 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 47.4 mm -76.43 -45.35 34.24 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.349 0 C-N-CA 118.108 -1.437 . . . . 73.41 107.594 178.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.452 ' HA ' ' NE ' ' A' ' 57' ' ' ARG . 10.7 ttm180 -55.85 -39.0 70.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.196 -0.911 . . . . 75.4 108.57 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.419 HD13 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -67.11 -54.45 21.26 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.142 -1.39 . . . . 73.23 111.193 177.722 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 22.2 ptm -72.89 -18.59 61.4 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.535 0.939 . . . . 74.11 113.535 -174.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 67.0 mtm180 -56.79 -37.89 71.78 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 108.126 -1.065 . . . . 74.34 108.126 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.534 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 21.6 m95 -65.59 -25.28 67.33 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.884 -1.507 . . . . 64.24 112.585 -176.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 64.3 tp -56.53 -40.54 75.26 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.214 0.53 . . . . 75.43 111.168 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -79.85 -30.67 40.41 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.796 -0.638 . . . . 70.11 109.5 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.569 ' HH2' ' O ' ' A' ' 20' ' ' ASP . 14.6 t90 -64.13 -38.67 91.91 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.612 -0.722 . . . . 73.25 109.679 -177.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.448 ' CE1' ' HE3' ' A' ' 87' ' ' MET . 52.0 m-85 -63.14 -54.14 42.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 121.678 0.751 . . . . 75.4 111.485 176.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.79 -14.79 63.24 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.802 -1.09 . . . . 75.53 111.528 -174.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.557 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 0.0 OUTLIER -53.72 -39.07 64.94 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 125.032 1.333 . . . . 75.05 111.383 173.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -114.58 27.97 9.07 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 122.376 1.084 . . . . 74.21 109.482 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 72.21 33.94 61.57 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.842 -1.072 . . . . 75.12 113.387 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -95.58 167.78 11.09 Favored 'General case' 0 CA--C 1.488 -1.405 0 C-N-CA 119.999 -0.68 . . . . 75.42 111.283 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.4 ' CG ' ' HB3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -140.38 107.67 5.52 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 115.048 1.499 . . . . 74.55 115.048 -165.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.428 HD23 ' CZ ' ' A' ' 62' ' ' PHE . 4.1 pp -168.12 160.56 11.92 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.966 -1.015 . . . . 72.21 108.548 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.59 ' HB ' ' OE1' ' A' ' 73' ' ' GLU . 10.4 m -115.64 170.62 8.3 Favored 'General case' 0 N--CA 1.402 -2.862 0 N-CA-C 105.706 -1.961 . . . . 75.44 105.706 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.403 HD11 HD12 ' A' ' 74' ' ' LEU . 4.7 tp -79.17 -23.41 43.94 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.563 -0.711 . . . . 71.34 112.461 -173.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -62.85 -27.33 69.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.886 0.374 . . . . 70.34 110.324 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.59 ' OE1' ' HB ' ' A' ' 70' ' ' THR . 2.3 mp0 -77.65 -36.29 51.65 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.044 -0.98 . . . . 72.11 109.464 -178.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.489 HD21 ' CD1' ' A' ' 83' ' ' TRP . 17.0 mt -68.48 -28.88 67.42 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.196 -1.365 . . . . 72.02 109.134 177.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.419 ' CE1' HD13 ' A' ' 55' ' ' LEU . 7.6 m-85 -87.06 4.92 40.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.203 -0.908 . . . . 72.24 111.471 173.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -100.15 -47.81 4.84 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.221 -1.029 . . . . 73.42 108.221 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.94 90.04 51.66 Favored Pre-proline 0 N--CA 1.433 -1.315 0 N-CA-C 107.83 -1.174 . . . . 63.52 107.83 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.491 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 50.2 Cg_endo -81.95 87.17 1.45 Allowed 'Trans proline' 0 N--CA 1.434 -2.027 0 C-N-CA 121.269 1.313 . . . . 71.54 112.947 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.625 ' HA ' ' O ' ' A' ' 43' ' ' SER . 2.6 p -155.31 148.56 24.84 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 107.199 -1.408 . . . . 74.34 107.199 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.535 HD11 ' O ' ' A' ' 40' ' ' HIS . 69.4 mt -52.19 -47.51 65.51 Favored 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 123.625 0.578 . . . . 73.41 110.367 177.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 85' ' ' GLN . . . -44.69 -43.87 8.69 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 113.397 -1.728 . . . . 73.31 112.185 -179.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.15 -51.23 67.25 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 121.046 -0.261 . . . . 75.33 111.173 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.489 ' CD1' HD21 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -64.23 -36.18 83.24 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 107.778 -1.193 . . . . 73.21 107.778 -175.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -65.28 -52.91 51.19 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.816 -1.538 . . . . 73.41 111.675 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 81' ' ' ALA . 77.7 mt-30 -66.19 -27.57 68.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.686 0.279 . . . . 72.54 110.971 -179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 98.5 mt -64.61 -19.78 65.88 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.104 -0.498 . . . . 75.01 111.472 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.689 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 41.7 mtt -76.67 -45.73 28.51 Favored 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 116.636 -0.256 . . . . 74.32 110.406 173.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.3 -11.44 60.81 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.568 0.699 . . . . 73.32 110.66 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.2 m -82.97 11.29 6.35 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-N 116.089 -0.505 . . . . 73.11 111.791 176.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.661 ' HG3' ' O ' ' A' ' 87' ' ' MET . 0.1 OUTLIER -95.08 -27.25 15.69 Favored 'General case' 0 CA--C 1.512 -0.484 0 C-N-CA 119.668 -0.813 . . . . 75.41 112.554 177.51 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.8 p -169.91 161.62 6.85 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 107.532 -1.284 . . . . 54.53 107.532 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -59.1 118.66 5.58 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.337 1.358 . . . . 73.14 109.278 173.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 . . . . . 0 N--CA 1.412 -2.336 0 N-CA-C 103.416 -2.809 . . . . 72.15 103.416 -176.234 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 CA--C 1.509 -0.599 0 N-CA-C 107.647 -1.242 . . . . 63.42 107.647 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -149.58 25.95 0.85 Allowed 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 109.066 -0.716 . . . . 75.55 109.066 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.634 ' HD3' ' H ' ' A' ' 17' ' ' HIS 0.567 0.0 OUTLIER -100.23 -74.06 0.62 Allowed 'General case' 0 N--CA 1.427 -1.598 0 C-N-CA 119.068 -1.053 . . . . 72.34 113.307 172.991 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.634 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 6.9 m170 -79.8 -27.65 40.33 Favored 'General case' 0 C--O 1.213 -0.826 0 O-C-N 121.163 -0.961 . . . . 73.4 109.229 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.52 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -66.19 -15.05 62.83 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.042 -0.981 . . . . 74.21 110.917 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -58.67 -28.97 66.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.922 -0.486 . . . . 75.03 110.17 173.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.01 -33.82 74.26 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.767 0.794 . . . . 71.04 108.932 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.52 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 89.8 t80 -61.45 -22.86 65.43 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 114.987 -1.006 . . . . 71.22 110.05 177.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' A' ' 19' ' ' ALA . 26.9 mt-30 -67.05 -24.16 65.96 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 116.481 -0.327 . . . . 73.21 111.45 176.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -76.89 -33.22 57.83 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 120.816 0.341 . . . . 74.4 110.829 173.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.497 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 5.8 tt -62.14 -43.79 98.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.313 -1.366 . . . . 72.43 107.313 170.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.506 ' HD3' HD23 ' A' ' 80' ' ' LEU . 42.9 ttp180 -67.79 -36.43 80.45 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.414 -1.266 . . . . 72.33 113.408 -176.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -58.48 -38.76 78.28 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 108.537 -0.912 . . . . 75.43 108.537 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.406 ' N ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -79.52 -31.78 42.19 Favored 'General case' 0 C--O 1.195 -1.793 0 C-N-CA 120.336 -0.546 . . . . 74.34 111.267 176.645 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -59.92 -36.94 78.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.118 0.417 . . . . 73.52 110.617 179.444 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 15.5 mm -58.84 -46.86 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-O 121.934 0.873 . . . . 72.22 108.678 174.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -69.87 -42.81 72.98 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.677 -1.147 . . . . 75.03 111.818 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CD ' ' HE ' ' A' ' 54' ' ' ARG . 5.7 mm-40 -47.44 -54.1 12.31 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.625 1.17 . . . . 75.1 113.937 -177.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.407 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 96.0 mt -103.47 9.8 37.51 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.1 -1.04 . . . . 74.14 112.276 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.46 28.75 16.95 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.705 0.764 . . . . 70.51 110.602 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.407 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 21.9 mt -80.64 129.9 34.79 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 107.329 -1.36 . . . . 75.02 107.329 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 35.6 p -78.95 157.38 76.31 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 108.593 -0.891 . . . . 75.15 108.593 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.11 -1.98 7.19 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.082 1.855 . . . . 61.14 113.346 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -98.02 -17.29 19.23 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 108.191 -1.04 . . . . 74.04 108.191 175.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -100.72 -39.45 7.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 114.67 -1.15 . . . . 74.54 108.331 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.4 tt -100.65 92.48 5.13 Favored 'General case' 0 N--CA 1.419 -2.01 0 CA-C-N 115.261 -0.881 . . . . 75.12 108.926 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -101.09 164.2 11.92 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 105.124 -2.176 . . . . 75.12 105.124 168.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . 0.34 14.3 pt-20 -77.6 -15.06 59.46 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 117.365 -1.734 . . . . 70.51 114.459 -169.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -81.68 -1.36 46.57 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.73 -0.668 . . . . 73.42 110.693 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 46.8 m -69.97 135.96 49.98 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-O 120.996 0.427 . . . . 71.2 111.416 178.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.524 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 44.4 t-20 -77.08 105.77 8.36 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.566 -1.272 . . . . 72.34 107.566 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 98.4 mt -66.24 -25.15 66.76 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.815 1.043 . . . . 73.24 113.815 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.6 mm -71.68 -34.38 52.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.698 -0.853 . . . . 75.33 108.698 178.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -80.09 -15.35 57.32 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.653 -0.703 . . . . 75.35 110.185 178.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.24 -11.23 55.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.792 -0.64 . . . . 73.24 109.355 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.47 30.04 10.35 Favored Glycine 0 N--CA 1.431 -1.648 0 CA-C-N 115.14 -0.936 . . . . 63.12 113.827 176.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.79 105.2 5.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 108.146 -1.057 . . . . 72.12 108.146 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.588 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.7 p30 -61.66 157.98 16.41 Favored 'General case' 0 C--O 1.252 1.2 0 CA-C-N 115.105 -0.952 . . . . 74.14 110.881 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.4 m -68.88 -16.91 63.89 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 113.05 0.759 . . . . 74.24 113.05 -177.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.513 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 43.2 mm -75.68 -39.94 39.76 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.679 0 C-N-CA 118.298 -1.361 . . . . 74.44 107.476 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.588 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 1.8 mpt_? -54.86 -49.27 71.54 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 109.36 -0.607 . . . . 75.3 109.36 173.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.42 HD21 ' CZ ' ' A' ' 75' ' ' TYR . 5.6 tp -59.88 -40.15 87.74 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.136 -1.393 . . . . 75.11 110.443 -177.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.6 mtt -83.16 -24.76 32.36 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 112.422 0.527 . . . . 72.33 112.422 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.9 mtm180 -68.3 -41.95 80.16 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.763 -1.199 . . . . 75.55 107.763 173.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.497 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 6.7 m95 -60.94 -41.97 97.29 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 114.618 -1.174 . . . . 74.11 112.796 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 67.3 tp -52.83 -41.56 64.34 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.429 0.633 . . . . 72.42 110.554 177.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -81.11 -21.06 40.19 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.494 -0.776 . . . . 74.14 112.299 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -65.81 -52.12 53.24 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.03 -1.1 . . . . 73.53 108.03 174.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -55.38 -50.43 69.73 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 121.881 0.848 . . . . 75.3 108.801 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 25.2 ttt180 -60.88 -28.34 68.81 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 113.689 -1.596 . . . . 72.0 111.091 -175.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.419 ' CA ' ' HZ1' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -83.15 -34.34 26.05 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 113.878 1.066 . . . . 72.13 113.878 176.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -78.63 -11.51 59.97 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 124.135 0.897 . . . . 72.13 111.72 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.69 6.62 49.56 Favored Glycine 0 CA--C 1.503 -0.684 0 N-CA-C 110.815 -0.914 . . . . 64.32 110.815 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -86.03 166.88 15.51 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 114.929 -0.635 . . . . 74.32 110.088 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.651 ' NH2' ' HA ' ' A' ' 92' ' ' PRO . 10.7 ptt180 -153.2 121.13 6.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 118.903 -1.119 . . . . 73.01 113.419 -166.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.1 pp -168.09 171.33 9.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.675 1.19 . . . . 73.42 108.631 174.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 81.1 p -109.5 142.92 39.87 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 109.212 -0.662 . . . . 72.32 109.212 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.417 ' HA ' HD11 ' A' ' 74' ' ' LEU . 23.8 tp -64.53 -24.31 67.56 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 112.174 0.435 . . . . 65.25 112.174 -176.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -60.02 -23.36 63.62 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.931 -0.577 . . . . 75.04 110.192 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -78.97 -39.48 34.23 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.262 -0.881 . . . . 65.43 110.13 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.417 HD11 ' HA ' ' A' ' 71' ' ' LEU . 6.1 mp -65.55 -27.93 68.8 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.138 0.975 . . . . 75.54 111.052 177.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.42 ' CZ ' HD21 ' A' ' 55' ' ' LEU . 45.1 m-85 -80.44 -37.76 31.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.008 -0.542 . . . . 74.3 110.915 173.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -64.23 -47.07 81.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.065 0.46 . . . . 74.12 110.978 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -123.21 87.38 51.43 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 108.303 -0.999 . . . . 73.51 108.303 175.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.524 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 20.5 Cg_endo -83.36 86.77 1.36 Allowed 'Trans proline' 0 N--CA 1.417 -2.993 0 C-N-CA 120.915 1.077 . . . . 64.14 112.502 -175.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.1 p -151.98 145.74 25.06 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 106.041 -1.837 . . . . 70.41 106.041 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.506 HD23 ' HD3' ' A' ' 25' ' ' ARG . 9.0 tt -66.25 -38.08 87.01 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 120.774 0.321 . . . . 74.43 110.763 -175.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 84' ' ' ASN . . . -59.63 -28.07 66.9 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.458 0.703 . . . . 72.3 110.806 177.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.24 -46.75 69.62 Favored 'General case' 0 C--O 1.2 -1.541 0 CA-C-N 115.753 -0.658 . . . . 73.13 110.683 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.474 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 0.5 OUTLIER -66.27 -34.76 78.72 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.221 -1.029 . . . . 75.31 108.221 -176.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.404 ' HB3' ' O ' ' A' ' 81' ' ' ALA . 48.5 t-20 -54.3 -55.44 28.33 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 74.52 108.566 176.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -71.5 -33.01 68.86 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-N 115.464 -0.789 . . . . 75.01 111.987 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 82.4 mt -56.85 -36.82 70.47 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 111.834 0.309 . . . . 71.44 111.834 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.498 ' O ' ' HD3' ' A' ' 92' ' ' PRO . 36.9 mtt -53.61 -61.01 2.58 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.68 0.612 . . . . 64.11 109.354 173.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.42 -17.13 63.62 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.442 1.275 . . . . 75.42 114.442 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.8 m -78.34 -15.96 58.19 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.514 0.673 . . . . 71.35 110.093 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 13.1 mmt180 -109.49 11.85 24.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.398 -1.334 . . . . 72.21 107.398 175.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.4 m 31.91 85.6 0.15 Allowed Pre-proline 0 C--O 1.234 0.241 0 C-N-CA 128.555 2.742 . . . . 74.54 115.514 175.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.651 ' HA ' ' NH2' ' A' ' 68' ' ' ARG . 11.8 Cg_endo -94.66 115.09 0.2 Allowed 'Trans proline' 0 N--CA 1.421 -2.793 0 C-N-CA 120.891 1.061 . . . . 74.13 110.486 174.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 127.978 2.511 . . . . 75.31 114.369 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.4 t0 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 106.411 -1.7 . . . . 62.24 106.411 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -139.21 108.52 6.11 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 117.912 0.324 . . . . 63.45 111.697 -171.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.623 ' HB2' ' OXT' ' A' ' 93' ' ' GLU . 0.7 OUTLIER -110.8 -76.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.298 -1.001 . . . . 73.13 108.298 174.561 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -77.8 -28.5 50.44 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 122.887 1.327 . . . . 73.11 107.882 169.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.89 -12.7 4.77 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 112.868 -1.969 . . . . 64.0 112.382 173.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -42.24 -27.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 114.084 1.142 . . . . 72.3 114.084 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -57.58 -42.33 82.9 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 109.313 -0.625 . . . . 74.22 109.313 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.592 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 71.3 t80 -59.04 -22.14 60.23 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.11 1.364 . . . . 72.41 111.315 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -59.15 -37.32 77.03 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.835 -0.432 . . . . 74.13 109.835 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.645 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 15.6 tt0 -71.3 -19.47 62.32 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.139 0.971 . . . . 74.14 110.774 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.539 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 5.4 tt -68.3 -21.71 64.76 Favored 'General case' 0 C--N 1.308 -1.229 0 O-C-N 121.478 -0.764 . . . . 75.12 109.801 173.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.477 HH21 ' HB3' ' A' ' 41' ' ' GLU . 2.5 mpt_? -80.86 -41.89 22.41 Favored 'General case' 0 CA--C 1.476 -1.885 0 O-C-N 121.688 -0.633 . . . . 73.44 109.802 -178.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 9.3 pt-20 -55.37 -40.77 71.73 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 124.549 1.156 . . . . 74.21 109.723 -174.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.492 ' HG3' ' HG3' ' A' ' 26' ' ' GLU . 91.0 mtt180 -87.69 -30.96 19.99 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.726 -0.67 . . . . 74.31 112.326 -178.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -66.41 -36.19 82.2 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.881 0.372 . . . . 73.53 110.402 178.497 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.451 HG23 ' O ' ' A' ' 34' ' ' LEU . 66.2 mt -60.17 -41.15 85.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.496 . . . . 73.33 109.828 176.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -72.89 -39.08 66.69 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.174 -0.466 . . . . 72.01 110.42 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -47.1 -54.11 11.21 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.298 1.439 . . . . 74.32 112.108 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.457 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 94.9 mt -106.95 10.48 30.46 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 119.197 -1.001 . . . . 75.2 112.836 177.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 58.37 42.64 21.11 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.28 1.038 . . . . 74.11 109.731 -177.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.457 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 37.1 mt -79.99 133.96 36.2 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.337 -1.301 . . . . 73.5 109.783 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -75.31 147.44 82.66 Favored Pre-proline 0 C--N 1.29 -1.989 0 N-CA-C 105.761 -1.94 . . . . 74.13 105.761 174.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -55.75 -28.99 69.52 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.792 1.662 . . . . 75.11 112.381 178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -76.76 -7.33 55.17 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 120.965 0.412 . . . . 72.14 110.864 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -111.76 -2.43 15.29 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.927 -1.138 . . . . 70.42 107.927 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.408 ' CD1' HD13 ' A' ' 80' ' ' LEU . 2.6 tm? -142.04 80.03 1.7 Allowed 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 122.377 1.084 . . . . 74.44 110.92 -176.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -117.33 166.35 12.39 Favored 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 105.42 -2.067 . . . . 74.41 105.42 172.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.496 ' HA ' ' HB2' ' A' ' 80' ' ' LEU 0.46 8.9 pt-20 -63.87 -11.72 30.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 118.437 2.755 . . . . 61.13 118.437 -171.788 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.57 -8.37 35.22 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 118.597 0.635 . . . . 73.03 109.461 -179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -67.24 126.97 30.91 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.336 -0.847 . . . . 65.2 111.28 -177.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.521 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 41.5 t-20 -75.3 117.89 17.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.342 -0.845 . . . . 73.32 110.222 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 86.9 mt -76.49 -25.05 53.85 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.473 1.286 . . . . 65.15 114.473 -174.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.405 HG12 ' CB ' ' A' ' 78' ' ' PRO . 37.0 mm -76.92 -33.1 20.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 109.07 -0.715 . . . . 71.32 109.07 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -78.65 -13.54 59.77 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.559 -0.746 . . . . 73.02 109.78 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.45 -29.33 28.13 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.684 -0.858 . . . . 70.11 108.684 175.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.94 30.48 2.31 Favored Glycine 0 N--CA 1.439 -1.145 0 N-CA-C 115.212 0.845 . . . . 63.21 115.212 174.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.1 mt -76.74 109.29 10.4 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 118.199 0.999 . . . . 74.43 110.609 175.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -70.7 167.55 18.45 Favored 'General case' 0 C--O 1.252 1.216 0 N-CA-C 109.223 -0.658 . . . . 71.25 109.223 174.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.44 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 15.6 m -68.47 -16.97 64.08 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.602 1.334 . . . . 74.31 114.602 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.612 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 51.4 mm -74.16 -43.79 50.55 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.539 0 N-CA-C 106.955 -1.498 . . . . 74.42 106.955 177.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -60.95 -40.11 92.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.788 -0.819 . . . . 74.44 108.788 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 52' ' ' SER . 43.3 mt -55.76 -50.55 70.1 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.948 -1.024 . . . . 74.15 111.124 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.5 ptp -79.53 -18.15 52.48 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.942 0.719 . . . . 75.34 112.942 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 94.4 mtt180 -59.61 -47.58 85.05 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 106.94 -1.504 . . . . 74.35 106.94 172.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -63.18 -36.71 84.52 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 113.929 -1.487 . . . . 74.04 113.102 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 60.2 tp -54.97 -36.31 65.22 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.433 0.635 . . . . 72.02 110.846 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -77.28 -30.17 54.17 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.745 -0.661 . . . . 73.54 110.82 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.423 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 69.2 t90 -71.81 -35.51 69.96 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.91 -0.586 . . . . 71.54 109.668 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -66.64 -50.69 62.13 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 122.034 0.921 . . . . 75.4 109.455 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -65.57 -13.64 59.43 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 114.408 -1.269 . . . . 75.11 111.372 -175.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.403 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 2.8 ttpm? -48.82 -44.69 39.57 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.948 1.699 . . . . 74.24 111.341 174.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -105.64 14.07 28.95 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 108.616 -0.883 . . . . 75.32 108.616 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 74.99 26.9 65.56 Favored Glycine 0 N--CA 1.42 -2.405 0 CA-C-N 114.95 -1.023 . . . . 63.24 111.845 -176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -66.36 162.8 19.54 Favored 'General case' 0 CA--C 1.484 -1.57 0 CA-C-N 117.498 0.649 . . . . 74.13 110.537 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 63.9 mtm-85 -134.65 99.75 4.43 Favored 'General case' 0 C--N 1.283 -2.309 0 C-N-CA 118.715 -1.194 . . . . 71.44 113.446 -162.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 pp -161.41 157.29 24.96 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.571 -0.74 . . . . 72.2 109.981 175.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.2 p -104.88 142.89 33.94 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 108.326 -0.99 . . . . 74.41 108.326 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.461 HD12 HD12 ' A' ' 74' ' ' LEU . 23.5 tp -61.85 -24.98 67.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.477 0.656 . . . . 75.42 110.207 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.521 ' C ' ' HD2' ' A' ' 72' ' ' ARG . 0.5 OUTLIER -53.73 -28.17 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 125.305 1.442 . . . . 73.5 110.265 175.637 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -86.52 -28.97 23.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.569 -0.741 . . . . 75.21 110.365 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.461 HD12 HD12 ' A' ' 71' ' ' LEU . 29.9 mt -75.48 -21.7 57.85 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.111 -0.95 . . . . 74.43 110.801 -177.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -78.87 -36.41 42.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.524 . . . . 71.05 109.788 173.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.27 75.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.583 -0.735 . . . . 65.51 110.847 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.73 87.13 56.66 Favored Pre-proline 0 N--CA 1.43 -1.459 0 N-CA-C 109.028 -0.73 . . . . 60.34 109.028 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.521 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 34.6 Cg_endo -90.38 86.55 0.36 Allowed 'Trans proline' 0 N--CA 1.418 -2.922 0 C-N-CA 121.058 1.172 . . . . 74.3 112.951 -177.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.1 p -150.17 147.05 27.25 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 105.118 -2.178 . . . . 75.3 105.118 175.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 41' ' ' GLU . 88.2 mt -50.93 -47.61 60.93 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 118.432 0.56 . . . . 73.1 111.193 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.53 -44.45 36.29 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 114.551 -1.204 . . . . 74.41 112.287 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.41 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.98 -44.28 69.76 Favored 'General case' 0 C--O 1.21 -1.009 0 N-CA-C 111.921 0.341 . . . . 72.25 111.921 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.535 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 3.9 m0 -63.25 -36.44 83.65 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.109 -1.071 . . . . 74.12 108.109 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.427 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 8.4 t30 -65.57 -48.46 72.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.352 -1.295 . . . . 73.14 109.845 177.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -58.35 -42.89 87.91 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.007 -0.997 . . . . 72.13 110.286 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 91.0 mt -65.99 -29.17 69.51 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.69 0.996 . . . . 75.31 113.69 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.592 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 7.6 ptp -82.25 -37.2 26.29 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 118.833 -1.147 . . . . 74.44 110.371 174.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.448 HD21 ' OXT' ' A' ' 93' ' ' GLU . 3.0 tm? -69.55 -39.64 77.3 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.627 -0.715 . . . . 72.44 110.861 -177.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.5 m -75.18 19.19 0.17 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.566 0.58 . . . . 71.35 112.566 -177.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 68' ' ' ARG . 24.3 mmt180 -128.78 -1.45 5.37 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 107.425 -1.324 . . . . 75.4 107.425 175.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.7 m -136.49 174.63 4.26 Favored Pre-proline 0 N--CA 1.437 -1.101 0 N-CA-C 108.385 -0.969 . . . . 74.31 108.385 -170.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.59 159.32 53.08 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 120.962 1.108 . . . . 73.43 109.962 170.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.623 ' OXT' ' HB2' ' A' ' 16' ' ' ARG . 43.4 mt-10 . . . . . 0 C--N 1.314 -0.947 0 O-C-N 123.809 0.693 . . . . 74.24 112.294 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.607 ' HB3' ' OXT' ' A' ' 93' ' ' GLU . 2.2 m-20 . . . . . 0 CA--C 1.488 -1.437 0 CA-C-O 118.275 -0.869 . . . . 62.15 109.642 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.447 ' OD1' ' HB1' ' A' ' 18' ' ' ALA . 18.4 t-20 72.83 80.46 0.14 Allowed 'General case' 0 N--CA 1.476 0.872 0 O-C-N 125.191 1.557 . . . . 71.53 107.516 -172.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.577 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 1.5 mpt_? -86.18 -71.07 0.56 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 114.522 1.305 . . . . 74.33 114.522 -169.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.536 ' HB3' ' CE1' ' A' ' 67' ' ' TYR . 47.2 m170 -54.1 -37.01 63.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.009 0.923 . . . . 74.02 112.701 -173.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -65.27 -14.99 62.01 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 113.854 1.057 . . . . 65.14 113.854 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.54 -32.68 63.15 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.847 -0.533 . . . . 70.14 110.887 174.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 28.3 t70 -70.01 -36.87 75.44 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 108.627 -0.879 . . . . 71.35 108.627 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.538 ' CE1' HD22 ' A' ' 24' ' ' LEU . 75.4 t80 -59.7 -22.53 62.11 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.778 -1.101 . . . . 72.33 111.139 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -68.16 -22.48 64.84 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.425 -0.51 . . . . 75.43 110.404 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.425 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 23.6 tp60 -72.95 -34.79 66.75 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.587 -0.894 . . . . 73.23 108.587 172.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.538 HD22 ' CE1' ' A' ' 21' ' ' TYR . 5.5 tt -70.31 -33.61 71.74 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.599 -0.889 . . . . 72.33 108.599 175.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.485 HH11 ' HB3' ' A' ' 80' ' ' LEU . 3.2 tpp180 -63.25 -49.02 75.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.011 -0.737 . . . . 73.44 109.011 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.492 ' OE1' ' HD2' ' A' ' 27' ' ' ARG . 4.2 tm-20 -53.34 -49.76 66.42 Favored 'General case' 0 CA--C 1.509 -0.599 0 O-C-N 124.438 1.086 . . . . 74.44 108.302 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.492 ' HD2' ' OE1' ' A' ' 26' ' ' GLU . 12.1 mmm180 -56.63 -50.99 70.41 Favored 'General case' 0 C--O 1.189 -2.13 0 CA-C-N 115.323 -0.853 . . . . 73.23 111.507 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 28.8 mt -50.68 -41.31 55.57 Favored 'General case' 0 C--O 1.245 0.826 0 N-CA-C 114.649 1.351 . . . . 73.03 114.649 -176.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.96 -48.97 85.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 O-C-N 123.605 0.566 . . . . 63.22 109.681 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -72.15 -44.54 62.94 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 112.842 0.682 . . . . 74.23 112.842 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -56.0 -53.12 60.81 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 123.939 0.896 . . . . 74.42 113.417 -176.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.421 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 96.5 mt -100.58 7.36 44.08 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 118.757 -1.177 . . . . 70.04 112.641 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.15 38.33 13.78 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.842 0.83 . . . . 74.44 109.936 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 54.6 mt -80.49 130.62 35.26 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 114.923 -1.035 . . . . 75.54 108.252 -177.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.0 p -76.24 162.93 69.43 Favored Pre-proline 0 C--N 1.299 -1.597 0 N-CA-C 108.693 -0.854 . . . . 75.13 108.693 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -63.03 -14.68 43.05 Favored 'Trans proline' 0 N--CA 1.487 1.141 0 C-N-CA 121.781 1.654 . . . . 74.25 113.151 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -98.22 0.49 45.89 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 121.644 0.735 . . . . 75.13 109.369 177.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -114.87 -8.69 12.54 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.538 -1.282 . . . . 72.15 107.538 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.414 ' CD1' HD11 ' A' ' 80' ' ' LEU . 2.2 tm? -143.12 76.18 1.51 Allowed 'General case' 0 N--CA 1.416 -2.128 0 CA-C-O 122.251 1.024 . . . . 74.15 109.62 -178.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.459 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 37.9 t-80 -117.44 165.67 13.24 Favored 'General case' 0 C--N 1.283 -2.289 0 N-CA-C 106.517 -1.66 . . . . 74.52 106.517 173.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.36 -33.23 5.62 Favored 'General case' 0 CA--C 1.569 1.71 0 C-N-CA 125.039 1.335 . . . . 71.53 113.703 -173.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.459 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.32 -1.88 37.8 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.91 -0.494 . . . . 75.3 111.401 -174.028 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -69.6 129.57 40.02 Favored 'General case' 0 C--O 1.251 1.152 0 CA-C-O 121.37 0.605 . . . . 63.35 112.112 -174.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 46.3 t-20 -74.24 112.33 10.29 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.359 -0.837 . . . . 65.22 109.689 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.1 mt -70.76 -26.18 63.24 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 114.469 1.285 . . . . 75.4 114.469 -176.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.7 mm -72.77 -33.75 44.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.657 -0.868 . . . . 74.43 108.657 178.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -81.02 -12.13 59.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.465 -0.789 . . . . 75.31 109.971 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.86 -7.94 59.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.032 -0.729 . . . . 72.35 109.032 176.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.9 37.06 6.15 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.939 -1.028 . . . . 60.2 113.245 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.78 103.64 16.16 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 108.219 -1.03 . . . . 73.13 108.219 178.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.477 ' OD1' ' HB2' ' A' ' 54' ' ' ARG . 3.9 p-10 -66.07 166.19 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.255 -0.884 . . . . 70.04 109.546 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -77.19 -14.74 59.73 Favored 'General case' 0 N--CA 1.424 -1.731 0 N-CA-C 114.401 1.26 . . . . 71.33 114.401 -174.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.627 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 46.2 mm -83.93 -36.96 12.69 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.35 0 N-CA-C 106.819 -1.549 . . . . 73.32 106.819 175.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.477 ' HB2' ' OD1' ' A' ' 51' ' ' ASP . 1.7 tpt85 -55.92 -45.73 78.66 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 106.936 -1.505 . . . . 75.5 106.936 174.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.17 -46.71 89.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.51 -1.677 . . . . 74.45 110.057 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 47.9 ttm -74.86 -25.33 58.9 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.217 -0.447 . . . . 71.34 112.016 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 37.0 mmt180 -64.29 -36.41 84.03 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.242 -0.651 . . . . 75.22 109.242 176.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -65.19 -29.61 70.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.998 -1.001 . . . . 65.11 112.148 179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.91 -27.1 66.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.403 0.62 . . . . 74.03 110.594 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -81.15 -40.73 23.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.032 -0.729 . . . . 74.23 109.032 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.512 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 24.4 t90 -63.29 -41.15 98.96 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 115.305 -0.862 . . . . 75.05 110.404 -177.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.456 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 61.5 m-85 -61.21 -51.2 70.0 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.813 0.816 . . . . 75.23 111.106 177.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -68.55 -13.23 62.19 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.256 -0.883 . . . . 75.44 113.221 -173.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.512 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 21.4 ttpp -44.9 -48.22 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.68 1.592 . . . . 74.5 112.5 173.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.411 ' HB2' ' CE2' ' A' ' 67' ' ' TYR . 6.5 m-20 -96.77 12.47 31.92 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.039 0.447 . . . . 74.43 110.397 -178.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 82.57 17.19 69.02 Favored Glycine 0 N--CA 1.421 -2.361 0 C-N-CA 120.24 -0.981 . . . . 63.11 111.486 -176.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 17' ' ' HIS . 27.7 m-85 -66.62 165.16 15.29 Favored 'General case' 0 CA--C 1.485 -1.523 0 CA-C-O 121.444 0.64 . . . . 74.54 111.314 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -136.54 103.45 5.25 Favored 'General case' 0 C--N 1.282 -2.369 0 C-N-CA 119.613 -0.835 . . . . 72.43 111.363 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 ' CD2' ' A' ' 62' ' ' PHE . 3.9 pp -159.64 152.34 21.49 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.537 0.523 . . . . 64.13 110.918 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -96.98 146.62 24.8 Favored 'General case' 0 N--CA 1.406 -2.651 0 N-CA-C 105.882 -1.896 . . . . 71.21 105.882 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 17.0 tp -72.65 -25.31 61.23 Favored 'General case' 0 C--N 1.291 -1.97 0 C-N-CA 120.057 -0.657 . . . . 75.24 110.471 -175.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -62.89 -19.98 64.71 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.087 -0.506 . . . . 71.4 110.413 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.58 -31.58 57.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.618 0.723 . . . . 71.03 109.194 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' A' ' 83' ' ' TRP . 18.0 mt -75.05 -22.52 58.34 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.339 -0.846 . . . . 75.45 109.485 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -87.76 -2.02 58.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.613 -0.721 . . . . 73.22 110.128 174.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.29 -51.52 5.26 Favored 'General case' 0 CA--C 1.503 -0.838 0 N-CA-C 108.751 -0.833 . . . . 75.35 108.751 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.39 87.45 56.22 Favored Pre-proline 0 N--CA 1.43 -1.459 0 N-CA-C 107.78 -1.193 . . . . 53.22 107.78 174.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.51 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 1.7 Cg_endo -81.16 86.75 1.57 Allowed 'Trans proline' 0 N--CA 1.43 -2.211 0 C-N-CA 121.146 1.231 . . . . 73.42 112.371 -175.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.2 p -153.23 153.38 32.59 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 105.857 -1.905 . . . . 72.32 105.857 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.485 ' HB3' HH11 ' A' ' 25' ' ' ARG . 37.9 mt -50.47 -50.79 51.49 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.832 0.708 . . . . 74.13 111.822 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -44.65 -43.7 8.46 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 113.854 -1.521 . . . . 71.25 113.225 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.631 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -65.14 -48.7 72.63 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 120.985 -0.286 . . . . 74.12 111.283 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.508 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -65.16 -35.43 81.06 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 108.124 -1.065 . . . . 74.44 108.124 -175.715 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -64.86 -53.73 42.02 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 114.655 -1.157 . . . . 75.41 109.436 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -70.27 -25.31 63.29 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.005 0.742 . . . . 55.24 113.005 -177.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 88.8 mt -62.21 -19.15 62.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.721 0.637 . . . . 72.25 112.721 179.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.41 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 59.0 mtt -74.97 -35.56 62.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.006 0.431 . . . . 74.14 110.007 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 93' ' ' GLU . 2.9 mm? -92.81 -14.05 28.32 Favored 'General case' 0 C--O 1.195 -1.779 0 N-CA-C 113.576 0.954 . . . . 74.01 113.576 178.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -74.68 22.35 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 CA-C-O 121.431 0.634 . . . . 72.3 111.811 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.469 ' H ' ' C ' ' A' ' 88' ' ' LEU . 22.7 mmt180 -132.02 2.01 3.95 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.486 -1.301 . . . . 75.11 107.486 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 49.0 m -159.8 -169.22 0.22 Allowed Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 107.234 -1.395 . . . . 65.55 107.234 -172.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -75.08 161.47 38.47 Favored 'Trans proline' 0 C--N 1.365 1.427 0 CA-C-N 121.125 1.437 . . . . 72.15 110.617 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.607 ' OXT' ' HB3' ' A' ' 14' ' ' ASP . 10.9 tp10 . . . . . 0 N--CA 1.473 0.691 0 C-N-CA 125.041 1.336 . . . . 74.34 110.473 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 . . . . . 0 N--CA 1.477 0.9 0 N-CA-C 108.817 -0.809 . . . . 74.2 108.817 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.459 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 6.5 p30 -94.94 164.0 13.09 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 123.578 0.751 . . . . 73.54 109.02 175.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.614 ' NE ' ' HB2' ' A' ' 93' ' ' GLU . 83.6 mtm180 -110.08 -79.71 0.58 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 119.354 -0.938 . . . . 71.21 112.954 -173.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.2 t-80 -81.62 -33.87 31.22 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 103.898 -2.631 . . . . 73.03 103.898 168.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.459 ' CB ' ' HB2' ' A' ' 15' ' ' ASN . . . -45.31 -14.45 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 110.878 -2.874 . . . . 74.31 114.134 174.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.54 -22.07 0.14 Allowed 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.968 0.907 . . . . 71.42 112.466 174.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.533 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 23.8 t70 -54.31 -42.07 69.69 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.32 -0.622 . . . . 73.22 109.32 170.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.534 ' HH ' ' HB2' ' A' ' 83' ' ' TRP . 69.1 t80 -60.27 -22.65 63.36 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 124.147 0.979 . . . . 73.32 110.466 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -60.44 -29.02 68.74 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.069 0.462 . . . . 74.42 110.203 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 27' ' ' ARG . 41.5 mm-40 -82.04 -24.94 35.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.696 0.628 . . . . 75.55 112.696 175.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.547 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 4.7 tt -73.35 -34.6 65.72 Favored 'General case' 0 C--O 1.208 -1.085 0 N-CA-C 107.062 -1.459 . . . . 74.51 107.062 173.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.472 HH21 ' CD ' ' A' ' 41' ' ' GLU . 5.1 tpt180 -57.48 -58.01 10.15 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.105 1.362 . . . . 73.43 109.389 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -58.28 -45.34 88.07 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.119 -0.946 . . . . 72.11 109.676 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -63.09 -45.93 89.76 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.011 -0.995 . . . . 73.03 110.555 -177.158 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.72 -44.74 86.18 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.488 0.715 . . . . 73.34 110.016 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.429 HG12 HD11 ' A' ' 39' ' ' LEU . 54.0 mt -63.89 -44.93 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 115.17 -0.923 . . . . 74.13 111.124 178.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -70.36 -36.01 73.9 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 113.602 0.964 . . . . 65.21 113.602 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.6 -42.25 99.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 116.241 1.941 . . . . 74.44 116.241 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 88.5 mt -95.51 17.69 14.19 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 118.366 -1.334 . . . . 74.43 111.348 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 60.56 37.89 19.21 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 122.969 1.366 . . . . 72.3 109.091 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 24.2 mt -88.45 164.66 15.37 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 114.287 -1.324 . . . . 74.01 108.433 -178.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.8 p -135.44 164.6 42.46 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 105.4 -2.074 . . . . 70.52 105.4 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.56 -16.09 45.73 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 121.919 1.746 . . . . 73.1 112.383 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -88.06 -28.83 21.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.274 -0.421 . . . . 74.32 110.271 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.458 HE21 HD23 ' A' ' 34' ' ' LEU . 27.8 tt0 -94.6 -19.31 20.58 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-O 121.406 0.622 . . . . 74.42 110.147 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.429 HD11 HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -128.21 93.96 3.79 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 107.354 -1.351 . . . . 61.43 107.354 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -97.98 147.76 24.16 Favored 'General case' 0 C--N 1.286 -2.188 0 N-CA-C 104.05 -2.574 . . . . 72.11 104.05 167.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.472 ' CD ' HH21 ' A' ' 25' ' ' ARG 0.362 8.9 pt-20 -78.63 5.72 10.4 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 118.91 2.93 . . . . 74.33 118.91 -166.463 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.52 -13.62 25.91 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.672 -1.232 . . . . 62.41 107.672 174.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.1 m -77.64 146.34 36.17 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 114.503 -1.226 . . . . 72.43 111.614 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.579 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.7 t-20 -77.76 115.77 17.77 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.027 -0.988 . . . . 74.25 110.817 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.43 -25.16 67.89 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.935 1.087 . . . . 72.51 113.935 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.5 mm -68.53 -32.65 56.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.834 -0.802 . . . . 74.12 108.834 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -80.5 -10.89 59.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.136 -0.938 . . . . 70.4 110.221 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -89.0 -5.44 57.95 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.748 -0.834 . . . . 74.41 108.748 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.01 31.91 10.45 Favored Glycine 0 N--CA 1.431 -1.667 0 CA-C-N 114.953 -1.021 . . . . 73.24 113.695 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.5 tp -76.7 102.07 6.04 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.131 -1.063 . . . . 74.32 108.131 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.547 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 4.2 p30 -59.3 153.48 18.66 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.75 -1.113 . . . . 75.24 109.784 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.463 ' O ' ' HG2' ' A' ' 56' ' ' MET . 32.3 m -71.8 -14.73 62.06 Favored 'General case' 0 N--CA 1.419 -1.978 0 N-CA-C 113.674 0.99 . . . . 74.21 113.674 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.676 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 46.4 mm -75.01 -43.81 44.92 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.27 0 C-N-CA 118.199 -1.401 . . . . 73.44 107.329 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.547 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 0.2 OUTLIER -50.62 -50.01 55.32 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 108.049 -1.093 . . . . 73.02 108.049 175.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.7 tp -56.78 -52.53 64.68 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 112.989 -1.914 . . . . 72.01 111.282 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 52' ' ' SER . 20.4 ptp -79.97 -18.9 49.17 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 113.951 1.093 . . . . 65.35 113.951 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.676 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 60.6 mtm180 -64.99 -42.6 94.37 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 106.327 -1.731 . . . . 74.33 106.327 172.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.547 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 6.1 m95 -56.93 -37.78 71.98 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 113.835 -1.53 . . . . 75.34 112.416 -178.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.7 -37.33 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.725 0.774 . . . . 71.1 109.862 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -81.03 -29.33 35.13 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.507 -0.769 . . . . 74.34 110.635 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.637 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 33.8 t90 -69.25 -36.98 77.71 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.886 -0.783 . . . . 74.24 108.886 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.445 ' CE1' HD21 ' A' ' 69' ' ' LEU . 59.8 m-85 -62.42 -50.29 72.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.518 1.152 . . . . 63.54 109.4 173.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -65.82 -12.65 55.89 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.699 -1.591 . . . . 75.31 113.9 -171.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 29.4 mtmm -48.35 -50.82 29.03 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-O 121.556 0.693 . . . . 73.42 110.599 178.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -100.88 17.59 21.77 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 114.861 -1.063 . . . . 72.55 108.982 -173.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.44 33.68 52.28 Favored Glycine 0 N--CA 1.419 -2.473 0 CA-C-N 114.899 -1.046 . . . . 73.23 112.804 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -71.12 166.15 22.05 Favored 'General case' 0 CA--C 1.478 -1.807 0 C-N-CA 118.996 -1.082 . . . . 74.1 111.107 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -138.81 106.58 5.64 Favored 'General case' 0 C--N 1.277 -2.581 0 CA-C-N 115.139 -0.937 . . . . 73.53 112.076 -165.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.445 HD21 ' CE1' ' A' ' 62' ' ' PHE . 3.1 pp -167.67 157.46 10.35 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 124.385 1.053 . . . . 74.54 108.828 170.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.1 p -102.73 146.11 28.72 Favored 'General case' 0 N--CA 1.414 -2.262 0 N-CA-C 108.498 -0.927 . . . . 64.53 108.498 176.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.427 HD13 HD11 ' A' ' 74' ' ' LEU . 18.7 tp -63.61 -24.27 67.73 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.504 0.669 . . . . 74.35 109.425 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 ttp180 -47.97 -35.49 10.89 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.212 1.405 . . . . 75.23 110.081 172.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -82.6 -28.71 30.67 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.106 -0.952 . . . . 73.44 110.384 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.438 HD23 ' CG ' ' A' ' 83' ' ' TRP . 19.5 mt -80.0 -18.78 49.38 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.093 -0.958 . . . . 73.23 109.972 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -85.84 -36.1 20.22 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.058 -0.519 . . . . 75.31 110.092 171.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.73 74.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.941 -0.572 . . . . 64.41 110.637 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -130.6 82.01 66.1 Favored Pre-proline 0 N--CA 1.432 -1.343 0 N-CA-C 109.233 -0.655 . . . . 75.05 109.233 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.579 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 1.1 Cg_endo -82.99 86.09 1.5 Allowed 'Trans proline' 0 N--CA 1.429 -2.32 0 C-N-CA 121.177 1.252 . . . . 71.44 111.294 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.2 p -143.48 136.74 27.97 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.157 -1.794 . . . . 70.41 106.157 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.418 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 38.2 tp -51.35 -41.09 60.37 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 123.263 0.625 . . . . 75.04 111.177 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.63 -33.49 75.73 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.17 -0.923 . . . . 74.22 111.741 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.554 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.38 -47.8 66.41 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-O 119.418 -0.325 . . . . 62.34 111.517 -177.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.534 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -61.79 -39.1 90.49 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 108.219 -1.03 . . . . 73.54 108.219 -176.052 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -61.54 -51.68 67.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.131 -1.395 . . . . 74.11 109.9 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.55 -27.1 64.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.751 -0.659 . . . . 73.33 111.816 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 78.1 mt -62.76 -33.6 75.49 Favored 'General case' 0 C--O 1.215 -0.718 0 N-CA-C 111.952 0.352 . . . . 73.42 111.952 177.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.516 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 51.4 mtt -59.15 -49.25 78.59 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.382 -0.527 . . . . 72.03 109.61 174.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.579 ' HA ' ' OE2' ' A' ' 93' ' ' GLU . 10.1 mp -64.8 -32.04 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.459 -0.791 . . . . 74.34 111.962 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.9 m -83.94 1.35 43.91 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.951 -0.568 . . . . 71.02 112.103 -177.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.479 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 43.0 mmt-85 -133.17 14.81 4.2 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.375 -0.602 . . . . 74.41 109.375 178.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 17.4 m -145.41 141.51 17.09 Favored Pre-proline 0 N--CA 1.446 -0.63 0 N-CA-C 111.802 0.297 . . . . 72.4 111.802 -176.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -87.07 118.18 1.39 Allowed 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 121.897 1.731 . . . . 72.54 108.228 167.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.614 ' HB2' ' NE ' ' A' ' 16' ' ' ARG . 18.9 mt-10 . . . . . 0 C--O 1.263 1.814 0 N-CA-C 106.525 -1.657 . . . . 73.54 106.525 -177.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.415 ' OD1' ' HG ' ' A' ' 88' ' ' LEU . 29.9 t70 . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 108.707 -0.849 . . . . 74.4 108.707 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -169.12 85.3 0.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.535 0.522 . . . . 62.32 110.771 178.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HG2' ' N ' ' A' ' 17' ' ' HIS 0.371 0.1 OUTLIER -110.26 -68.89 0.9 Allowed 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 117.702 -1.599 . . . . 74.24 112.545 170.575 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.408 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 40.5 m170 -77.72 -20.88 52.76 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.786 -0.571 . . . . 74.31 112.522 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.17 -15.14 2.03 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.12 0.968 . . . . 52.3 113.308 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.86 -32.37 14.19 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.756 0.422 . . . . 73.22 111.002 172.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.471 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 16.2 t70 -58.76 -42.59 89.26 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.867 -0.79 . . . . 65.5 108.867 175.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.712 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 64.8 t80 -61.31 -21.1 63.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.434 1.093 . . . . 72.13 111.732 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.574 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 8.3 tt0 -62.12 -38.61 89.56 Favored 'General case' 0 C--O 1.193 -1.896 0 N-CA-C 108.494 -0.928 . . . . 70.44 108.494 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.405 ' HA ' ' HG2' ' A' ' 26' ' ' GLU . 6.8 tp-100 -64.24 -21.45 66.59 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.868 0.842 . . . . 64.15 109.994 179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.596 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 7.4 tt -77.51 -24.5 50.05 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 116.02 -0.536 . . . . 74.21 109.615 175.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 41' ' ' GLU . 5.0 mpt_? -73.41 -50.77 20.06 Favored 'General case' 0 CA--C 1.47 -2.099 0 N-CA-C 107.937 -1.135 . . . . 74.55 107.937 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 1.6 mm-40 -47.3 -46.75 25.37 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.774 1.921 . . . . 73.04 109.768 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -83.61 -31.8 26.06 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 115.858 -0.61 . . . . 74.54 112.018 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.596 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -58.14 -41.12 83.03 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 109.707 -0.479 . . . . 74.24 109.707 179.448 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 25' ' ' ARG . 73.7 mt -61.79 -32.71 54.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 115.126 -0.943 . . . . 71.55 110.058 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -80.01 -46.24 16.97 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.005 -0.543 . . . . 73.13 111.463 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -49.58 -53.54 23.25 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.359 1.244 . . . . 54.05 114.359 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 85.0 mt -98.25 5.22 48.58 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 118.359 -1.336 . . . . 74.51 111.667 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.1 t30 54.35 72.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.252 1.025 . . . . 71.34 109.138 -173.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.0 mt -107.84 150.03 27.53 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.655 -1.157 . . . . 75.15 109.583 -173.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.2 p -88.81 159.87 45.12 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 107.726 -1.213 . . . . 74.45 107.726 174.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -67.33 -4.8 12.46 Favored 'Trans proline' 0 N--CA 1.492 1.416 0 C-N-CA 122.169 1.913 . . . . 73.52 113.722 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.589 HE21 ' HA ' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -97.95 -28.34 13.85 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.297 -1.001 . . . . 75.23 108.297 174.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -80.29 -37.61 32.4 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 114.9 -1.046 . . . . 72.12 108.62 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -104.97 85.78 2.34 Favored 'General case' 0 N--CA 1.412 -2.33 0 N-CA-C 106.86 -1.533 . . . . 73.33 106.86 175.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 t-80 -125.2 160.48 29.07 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 105.077 -2.194 . . . . 74.33 105.077 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.483 ' CD ' HH21 ' A' ' 25' ' ' ARG . 28.1 mm-40 -54.45 -48.09 72.14 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.507 0.67 . . . . 75.23 111.593 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -80.12 11.74 3.27 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 125.06 1.344 . . . . 75.32 112.665 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.413 ' O ' ' HA ' ' A' ' 79' ' ' THR . 32.3 t -92.61 140.43 29.55 Favored 'General case' 0 C--O 1.254 1.295 0 O-C-N 121.832 -0.543 . . . . 70.43 110.402 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.514 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 41.3 t-20 -85.05 108.8 17.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.631 0.729 . . . . 71.24 109.998 -178.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.5 mt -68.24 -23.04 64.74 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 114.917 1.451 . . . . 74.33 114.917 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.3 mm -77.8 -32.28 17.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 N-CA-C 108.756 -0.831 . . . . 70.4 108.756 177.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -77.74 -23.73 49.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.689 -0.687 . . . . 75.31 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.49 -24.91 62.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.76 -0.654 . . . . 75.21 109.611 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.25 36.2 3.68 Favored Glycine 0 N--CA 1.436 -1.3 0 CA-C-N 115.61 -0.723 . . . . 50.45 114.331 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.4 mt -63.48 111.94 2.55 Favored 'General case' 0 CA--C 1.484 -1.58 0 CA-C-N 117.706 0.753 . . . . 72.03 112.385 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.56 139.93 24.28 Favored 'General case' 0 C--O 1.249 1.05 0 CA-C-N 113.8 -1.545 . . . . 64.14 108.608 170.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.6 m -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 116.409 -0.359 . . . . 75.51 111.858 -175.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.498 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 50.4 mm -71.32 -40.3 73.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.562 0 C-N-CA 118.529 -1.268 . . . . 63.55 108.743 174.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -59.12 -43.31 91.93 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.474 -0.565 . . . . 75.44 109.474 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.7 tp -57.76 -44.43 86.14 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.71 -1.132 . . . . 74.43 109.749 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.9 mtt -85.17 -18.27 34.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.925 -0.579 . . . . 63.21 112.423 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.666 ' NE ' ' HA ' ' A' ' 57' ' ' ARG . 4.4 mmp_? -74.3 -36.75 63.77 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 109.46 -0.57 . . . . 74.34 109.46 174.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 4.3 m95 -62.98 -37.97 89.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.354 -0.839 . . . . 72.52 111.475 176.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.12 -36.05 72.37 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.512 0.672 . . . . 74.21 110.592 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -77.52 -38.05 49.66 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.018 -0.992 . . . . 74.44 108.684 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.471 ' HH2' ' O ' ' A' ' 20' ' ' ASP . 71.7 t90 -59.49 -35.97 75.14 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 114.935 -1.029 . . . . 75.43 111.217 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.587 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 40.2 m-85 -64.61 -54.32 33.84 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.345 1.069 . . . . 73.41 108.82 176.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -65.22 -13.22 57.78 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.742 -1.572 . . . . 71.14 114.116 -171.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.7 pttm -54.43 -33.67 59.91 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.046 0.538 . . . . 75.24 110.804 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -108.48 14.84 24.37 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.288 -0.634 . . . . 74.04 109.288 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.09 24.25 64.38 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.432 -0.89 . . . . 54.33 111.816 -176.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.587 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 3.2 m-85 -72.13 162.72 29.06 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 121.508 0.67 . . . . 71.35 111.816 177.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -133.13 98.07 4.17 Favored 'General case' 0 C--N 1.28 -2.421 0 CA-C-N 115.201 -0.909 . . . . 73.43 110.877 -165.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.0 mt -144.68 151.56 39.13 Favored 'General case' 0 C--O 1.257 1.494 0 CA-C-N 116.414 -0.357 . . . . 74.43 111.071 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.5 m -105.39 141.98 35.94 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 106.17 -1.789 . . . . 72.22 106.17 173.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.41 HD11 HD12 ' A' ' 74' ' ' LEU . 29.7 tp -79.54 -26.09 41.53 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 120.58 -0.448 . . . . 73.33 110.776 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -66.3 -16.95 64.45 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 116.213 -0.449 . . . . 74.31 110.519 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -83.83 -28.16 28.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.393 -0.822 . . . . 74.24 109.339 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.424 HD22 ' CG ' ' A' ' 83' ' ' TRP . 33.7 mt -78.92 -17.53 55.37 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.593 -1.185 . . . . 74.0 110.081 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -83.94 -38.73 20.67 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.158 -0.682 . . . . 74.25 109.158 171.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.29 -48.09 82.99 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.439 -0.8 . . . . 74.34 110.549 -177.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.38 85.57 55.57 Favored Pre-proline 0 N--CA 1.428 -1.562 0 N-CA-C 108.034 -1.099 . . . . 75.24 108.034 173.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.514 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 37.3 Cg_endo -85.06 86.34 1.14 Allowed 'Trans proline' 0 N--CA 1.417 -2.996 0 C-N-CA 120.851 1.034 . . . . 75.42 111.74 -176.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 43' ' ' SER . 2.7 p -150.97 142.05 23.09 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 107.338 -1.356 . . . . 71.44 107.338 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.415 HD13 ' OH ' ' A' ' 21' ' ' TYR . 57.0 tp -53.33 -44.28 68.32 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 124.151 0.907 . . . . 74.01 110.996 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.466 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -55.37 -40.01 70.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.872 -1.058 . . . . 75.21 111.806 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.29 68.11 Favored 'General case' 0 C--O 1.205 -1.264 0 CA-C-N 115.93 -0.577 . . . . 71.32 111.426 -176.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.472 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 4.2 m0 -61.76 -40.02 93.68 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 107.826 -1.176 . . . . 74.43 107.826 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 21.5 t30 -57.95 -56.07 26.74 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.411 -1.268 . . . . 62.32 111.081 177.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -72.61 -25.12 61.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.423 0.527 . . . . 61.32 112.423 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.0 mt -65.09 -30.73 71.69 Favored 'General case' 0 C--O 1.207 -1.164 0 C-N-CA 121.205 -0.198 . . . . 64.42 110.674 173.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.712 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 29.6 mtt -57.91 -45.32 86.66 Favored 'General case' 0 C--O 1.194 -1.865 0 C-N-CA 120.3 -0.56 . . . . 73.24 110.58 173.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.415 ' HG ' ' OD1' ' A' ' 14' ' ' ASP . 2.1 mm? -75.8 -14.97 60.31 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 112.687 0.625 . . . . 73.12 112.687 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 p -108.72 0.3 20.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 112.395 0.517 . . . . 70.51 112.395 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 46.9 mmt-85 -127.9 -28.8 2.63 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.107 0.479 . . . . 74.34 110.643 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.6 m -118.07 78.55 13.37 Favored Pre-proline 0 C--N 1.304 -1.383 0 N-CA-C 109.56 -0.534 . . . . 71.14 109.56 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -82.71 116.54 2.56 Favored 'Trans proline' 0 N--CA 1.423 -2.623 0 N-CA-C 107.099 -1.923 . . . . 71.11 107.099 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.44 -0.949 0 O-C-N 125.035 1.459 . . . . 64.04 111.335 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 107.497 -1.297 . . . . 71.42 107.497 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -87.7 -174.75 4.9 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.105 -1.072 . . . . 74.35 108.105 169.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.641 ' NH2' ' HA ' ' A' ' 93' ' ' GLU 0.335 0.0 OUTLIER -110.17 -75.51 0.62 Allowed 'General case' 0 CA--C 1.559 1.325 0 N-CA-C 115.839 1.792 . . . . 73.43 115.839 -173.766 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.581 ' HB2' ' OXT' ' A' ' 93' ' ' GLU . 4.4 t60 -69.03 -27.0 65.28 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 123.048 1.404 . . . . 63.32 107.867 177.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.5 -12.12 60.4 Favored 'General case' 0 C--O 1.181 -2.52 0 C-N-CA 127.722 2.409 . . . . 73.04 113.834 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -41.19 -25.06 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.241 0 N-CA-C 115.749 1.759 . . . . 73.13 115.749 -172.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.457 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 28.8 t70 -61.4 -35.85 78.66 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.951 -0.759 . . . . 73.23 108.951 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.6 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 78.8 t80 -60.51 -28.8 68.67 Favored 'General case' 0 CA--C 1.503 -0.829 0 C-N-CA 124.326 1.05 . . . . 63.42 110.567 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -61.34 -30.89 70.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 119.683 -0.807 . . . . 75.41 110.867 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 26.6 tp60 -70.62 -39.11 73.93 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.146 -1.057 . . . . 73.24 108.146 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.592 HD21 ' CE1' ' A' ' 21' ' ' TYR . 4.5 tt -64.83 -34.76 79.12 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.784 -0.45 . . . . 74.12 109.784 176.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.487 ' NH1' ' HB3' ' A' ' 80' ' ' LEU . 3.3 tpp180 -64.04 -48.49 76.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.004 -0.739 . . . . 74.33 109.004 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -55.18 -44.27 75.1 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 114.56 -1.2 . . . . 73.43 109.42 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 27' ' ' ARG . 3.3 mmp_? -61.6 -56.23 22.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.136 -0.938 . . . . 75.5 111.28 176.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 20.3 mt -51.66 -43.7 62.78 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.156 1.169 . . . . 74.13 114.156 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 62.3 mt -66.65 -34.23 68.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.048 -0.524 . . . . 74.42 111.465 -177.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.03 -32.7 24.74 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.63 -0.428 . . . . 73.2 111.306 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -48.06 -53.65 15.72 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.162 0.801 . . . . 62.43 113.162 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.446 ' N ' HD13 ' A' ' 32' ' ' LEU . 3.7 mp -107.75 11.51 28.22 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.097 -1.041 . . . . 74.22 111.778 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 57.01 46.54 19.17 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 122.231 1.015 . . . . 71.42 109.802 -176.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.431 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 60.6 mt -79.78 130.37 35.27 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.514 -1.221 . . . . 75.21 109.221 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.8 m -75.25 148.7 84.03 Favored Pre-proline 0 C--N 1.289 -2.065 0 N-CA-C 107.017 -1.475 . . . . 61.32 107.017 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -57.33 -21.08 42.61 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 C-N-CA 121.815 1.677 . . . . 74.33 111.954 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -85.24 -6.9 59.24 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.935 -0.575 . . . . 71.25 109.959 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.7 tp60 -104.89 -31.19 9.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 123.818 0.847 . . . . 74.14 108.725 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 21.1 tp -126.32 91.81 3.44 Favored 'General case' 0 N--CA 1.411 -2.416 0 CA-C-O 121.57 0.7 . . . . 63.11 111.758 -176.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.437 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 32.9 t-80 -115.24 166.77 11.48 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 106.594 -1.632 . . . . 73.23 106.594 173.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' OE1' ' HA ' ' A' ' 41' ' ' GLU . 6.6 mm-40 -42.73 -40.32 2.76 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 114.668 1.358 . . . . 72.11 114.668 -178.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -89.57 -6.13 56.59 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.812 -0.555 . . . . 74.2 111.426 -173.133 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.7 m -72.96 127.19 31.83 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-O 121.126 0.489 . . . . 52.25 110.879 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 54.9 m-80 -73.33 119.06 17.05 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.679 0.752 . . . . 72.3 112.274 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 18.8 mt -69.84 -26.42 64.21 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.832 -1.077 . . . . 73.42 112.893 -178.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.441 HG12 ' CB ' ' A' ' 78' ' ' PRO . 43.9 mm -72.88 -29.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 109.075 -0.713 . . . . 73.51 109.075 175.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -78.18 -23.91 47.42 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 109.718 -0.475 . . . . 74.24 109.718 177.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.8 -34.31 69.28 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.653 -0.703 . . . . 63.23 109.17 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.43 37.03 1.37 Allowed Glycine 0 N--CA 1.438 -1.226 0 C-N-CA 120.588 -0.815 . . . . 71.24 114.045 175.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.452 ' CD1' ' HB3' ' A' ' 45' ' ' LEU . 50.6 mt -68.77 114.94 7.56 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 117.473 0.636 . . . . 73.23 109.965 175.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -71.8 157.01 38.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 107.653 -1.24 . . . . 75.33 107.653 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.9 m -67.23 -14.9 63.34 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 113.708 1.003 . . . . 61.42 113.708 -174.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.52 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 49.4 mm -79.27 -44.19 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.275 0 C-N-CA 118.42 -1.312 . . . . 64.34 107.948 177.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.415 ' HG2' ' NH2' ' A' ' 57' ' ' ARG . 41.7 mtt180 -59.38 -43.63 92.86 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 108.44 -0.948 . . . . 74.45 108.44 176.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.37 -46.23 86.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.449 -1.251 . . . . 74.41 109.869 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 36.9 ttm -81.58 -19.03 42.8 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 112.662 0.615 . . . . 75.44 112.662 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 78.6 mtt180 -59.29 -47.49 85.17 Favored 'General case' 0 C--N 1.349 0.574 0 N-CA-C 106.202 -1.777 . . . . 74.22 106.202 173.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -59.33 -36.48 75.74 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 112.883 -1.962 . . . . 75.25 113.395 -174.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.18 -43.06 96.15 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.302 0.572 . . . . 72.44 110.496 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -74.98 -34.64 62.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.57 -0.741 . . . . 73.43 109.368 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.57 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 68.9 t90 -61.67 -35.25 77.44 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.719 -1.128 . . . . 73.41 110.453 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.408 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 28.4 m-85 -68.16 -52.2 37.24 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.399 1.095 . . . . 74.54 109.606 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -69.24 -13.09 62.21 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.076 -1.42 . . . . 73.34 114.084 -172.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.7 pttm -57.8 -32.83 67.93 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.028 0.442 . . . . 72.42 109.93 175.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -108.3 14.94 24.49 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 108.896 -0.779 . . . . 74.24 108.896 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.58 83.68 Favored Glycine 0 N--CA 1.427 -1.945 0 CA-C-N 114.998 -1.001 . . . . 71.13 113.181 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.408 ' HB2' ' HB3' ' A' ' 62' ' ' PHE . 21.1 m-85 -67.49 162.97 22.06 Favored 'General case' 0 CA--C 1.498 -1.056 0 CA-C-N 117.927 0.863 . . . . 74.4 111.936 175.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.496 ' HD3' ' N ' ' A' ' 68' ' ' ARG . 0.4 OUTLIER -112.74 58.84 0.64 Allowed 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 115.009 -0.996 . . . . 74.52 111.68 -167.836 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.7 mt -130.0 149.28 51.79 Favored 'General case' 0 CA--C 1.497 -1.093 0 C-N-CA 120.587 -0.445 . . . . 71.33 111.306 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 m -118.04 148.09 42.59 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 106.427 -1.694 . . . . 75.21 106.427 170.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.444 HD11 HD11 ' A' ' 74' ' ' LEU . 20.4 tp -76.05 -24.34 55.13 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.81 0.338 . . . . 74.21 111.051 -173.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.26 -21.75 62.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.143 0.497 . . . . 75.15 110.015 178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -80.78 -32.38 35.45 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.135 -0.939 . . . . 71.33 109.182 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.45 HD21 ' CD1' ' A' ' 83' ' ' TRP . 48.8 mt -82.54 -17.86 43.51 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.572 -1.194 . . . . 72.13 110.791 -175.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -78.11 -34.51 50.0 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.308 -0.405 . . . . 74.02 109.92 170.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -72.54 -43.53 63.37 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.729 -0.668 . . . . 74.34 110.472 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -128.79 88.85 50.77 Favored Pre-proline 0 N--CA 1.433 -1.296 0 N-CA-C 108.725 -0.842 . . . . 72.54 108.725 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.517 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 37.9 Cg_endo -96.74 85.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.423 -2.667 0 C-N-CA 121.259 1.306 . . . . 70.01 113.267 -176.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.6 p -146.14 154.99 42.42 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 105.318 -2.105 . . . . 75.42 105.318 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.487 ' HB3' ' NH1' ' A' ' 25' ' ' ARG . 26.8 mt -54.07 -44.35 71.06 Favored 'General case' 0 C--O 1.249 1.027 0 CA-C-N 118.842 0.746 . . . . 74.1 110.814 177.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.88 -46.87 64.66 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 114.388 -1.278 . . . . 63.52 111.927 -177.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.74 99.51 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 112.341 0.497 . . . . 74.01 112.341 -177.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.507 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 2.6 m0 -68.59 -37.89 80.21 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 108.309 -0.997 . . . . 72.43 108.309 -176.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -68.04 -51.81 42.58 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.824 -1.08 . . . . 71.31 109.973 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -60.88 -41.31 95.75 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.263 1.025 . . . . 74.21 111.646 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.82 -36.37 80.94 Favored 'General case' 0 C--O 1.199 -1.557 0 CA-C-N 116.756 -0.202 . . . . 75.41 111.169 177.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.6 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 45.4 mtt -62.2 -48.35 80.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.038 -0.665 . . . . 74.51 111.115 175.182 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.33 -24.33 66.51 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.0 0.741 . . . . 75.14 113.0 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 p -94.17 6.04 49.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.43 0.633 . . . . 75.11 111.484 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -129.52 16.67 5.94 Favored 'General case' 0 C--O 1.248 1.016 0 N-CA-C 109.01 -0.737 . . . . 72.2 109.01 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.2 m -146.33 148.33 34.16 Favored Pre-proline 0 N--CA 1.432 -1.365 0 N-CA-C 108.776 -0.824 . . . . 74.42 108.776 -178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.25 117.38 3.79 Favored 'Trans proline' 0 N--CA 1.439 -1.691 0 N-CA-C 108.327 -1.451 . . . . 63.24 108.327 170.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.641 ' HA ' ' NH2' ' A' ' 16' ' ' ARG . 15.5 mm-40 . . . . . 0 C--O 1.279 2.658 0 O-C-N 125.152 1.532 . . . . 71.13 113.765 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.559 ' OD1' ' HG3' ' A' ' 16' ' ' ARG . 20.5 t70 . . . . . 0 CA--C 1.499 -0.997 0 N-CA-C 108.494 -0.928 . . . . 60.43 108.494 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -157.47 22.27 0.29 Allowed 'General case' 0 C--N 1.312 -1.044 0 O-C-N 124.302 1.001 . . . . 53.01 109.542 176.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.559 ' HG3' ' OD1' ' A' ' 14' ' ' ASP 0.486 0.0 OUTLIER -46.69 -74.13 0.04 OUTLIER 'General case' 0 C--N 1.373 1.607 0 N-CA-C 117.436 2.384 . . . . 74.44 117.436 -173.565 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -78.35 -21.02 50.12 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.67 0.747 . . . . 73.21 111.85 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.5 -16.13 53.95 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.164 -0.926 . . . . 74.11 111.69 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.34 -34.46 33.89 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 122.333 0.253 . . . . 70.3 110.968 173.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.606 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 24.2 t70 -61.82 -40.72 96.27 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.358 0.599 . . . . 74.3 109.493 176.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.569 ' CE1' HD23 ' A' ' 24' ' ' LEU . 53.6 t80 -66.1 -22.39 66.4 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.807 -1.088 . . . . 72.4 112.084 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -65.45 -29.75 70.47 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.659 0.615 . . . . 73.32 112.659 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.606 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 10.0 pt20 -74.68 -19.54 60.22 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.642 -0.873 . . . . 75.33 108.642 178.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.569 HD23 ' CE1' ' A' ' 21' ' ' TYR . 5.2 tt -72.96 -38.95 66.56 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.85 -0.796 . . . . 74.24 108.85 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.433 HH22 ' CD ' ' A' ' 41' ' ' GLU . 1.6 mpt_? -58.44 -46.69 86.02 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 110.119 -0.326 . . . . 74.43 110.119 175.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -44.08 -52.89 6.84 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 125.168 1.542 . . . . 75.53 110.407 179.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -86.43 -32.02 21.09 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.207 -0.906 . . . . 72.14 113.141 -173.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.5 tt -59.55 -33.12 71.02 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 122.987 0.515 . . . . 72.22 110.269 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 77.4 mt -64.88 -33.29 62.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.647 -0.706 . . . . 75.34 111.493 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -81.81 -29.8 32.49 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 121.753 -0.592 . . . . 74.23 111.299 176.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.449 ' CD ' ' HE ' ' A' ' 54' ' ' ARG . 6.6 mm-40 -54.77 -54.11 46.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.268 0.84 . . . . 74.43 113.268 -177.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.463 ' N ' HD12 ' A' ' 32' ' ' LEU . 4.7 mp -95.89 7.88 45.12 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.39 -0.524 . . . . 74.23 111.793 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.7 t30 57.83 65.78 1.25 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.835 1.302 . . . . 73.5 108.732 -173.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.6 mt -108.14 -176.11 2.96 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 113.986 -1.461 . . . . 74.13 108.281 -177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.1 m -146.39 148.13 33.33 Favored Pre-proline 0 C--N 1.277 -2.562 0 N-CA-C 104.277 -2.49 . . . . 75.03 104.277 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -55.55 -28.61 65.74 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 C-N-CA 122.056 1.838 . . . . 74.13 112.633 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mp0 -75.22 -12.19 60.24 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.014 0.435 . . . . 75.35 110.99 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -102.09 -40.63 6.74 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.228 -0.656 . . . . 72.25 109.228 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.2 tp -109.47 94.57 5.1 Favored 'General case' 0 N--CA 1.412 -2.361 0 CA-C-N 115.346 -0.843 . . . . 74.03 112.774 -173.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -102.67 165.12 11.25 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 104.759 -2.312 . . . . 75.22 104.759 168.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.433 ' CD ' HH22 ' A' ' 25' ' ' ARG 0.378 12.0 pt-20 -76.45 -1.45 27.15 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 117.994 2.59 . . . . 72.24 117.994 -169.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.33 -9.41 35.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.936 -0.765 . . . . 64.22 108.936 178.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.1 m -68.77 132.92 47.61 Favored 'General case' 0 N--CA 1.425 -1.713 0 CA-C-N 114.851 -1.068 . . . . 72.32 111.287 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 39.8 t-20 -77.11 114.14 15.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.495 -0.775 . . . . 65.32 110.453 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.425 HD11 ' CD2' ' A' ' 80' ' ' LEU . 86.9 mt -70.14 -29.85 66.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 114.157 1.169 . . . . 74.23 114.157 -175.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.8 mm -72.02 -34.05 49.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 C-N-CA 120.153 -0.619 . . . . 71.33 109.67 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -78.47 -13.38 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.871 -0.604 . . . . 74.32 110.38 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -88.48 -9.75 51.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.636 -0.711 . . . . 73.45 109.152 175.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 88.09 36.79 8.09 Favored Glycine 0 N--CA 1.437 -1.291 0 CA-C-N 115.306 -0.861 . . . . 63.35 113.775 177.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.0 106.1 9.64 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.032 -1.099 . . . . 73.25 108.032 176.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.593 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.6 p30 -63.2 157.18 23.2 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 114.501 -1.227 . . . . 73.42 111.383 -177.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -68.0 -14.38 62.92 Favored 'General case' 0 N--CA 1.423 -1.825 0 N-CA-C 113.561 0.949 . . . . 72.22 113.561 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.507 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.1 mm -80.36 -38.87 18.38 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.44 0 C-N-CA 117.964 -1.495 . . . . 75.1 107.921 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.593 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 2.1 mpt_? -57.08 -47.16 81.7 Favored 'General case' 0 CA--C 1.492 -1.264 0 N-CA-C 108.715 -0.846 . . . . 73.12 108.715 173.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.13 -43.11 91.95 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 113.724 -1.58 . . . . 72.42 109.876 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.9 tpp -75.33 -33.86 61.17 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-N 116.207 -0.451 . . . . 62.32 110.964 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.507 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 42.5 mtm180 -64.44 -43.0 95.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 109.312 -0.625 . . . . 74.12 109.312 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -65.03 -37.9 89.13 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.113 -0.949 . . . . 72.5 111.852 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.5 tp -54.64 -35.2 63.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.534 0.683 . . . . 75.23 111.284 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -81.43 -36.45 29.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.955 -0.566 . . . . 75.41 110.278 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.461 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 75.2 t90 -61.25 -40.57 94.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.557 -0.747 . . . . 74.23 110.788 178.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.504 ' CD1' HD11 ' A' ' 69' ' ' LEU . 52.7 m-85 -63.06 -53.35 55.06 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 122.098 0.951 . . . . 71.51 111.487 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -67.94 -12.69 61.22 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 114.542 -1.208 . . . . 74.33 113.607 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 23.3 pttm -54.58 -33.7 60.71 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.727 0.411 . . . . 75.12 110.722 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -108.32 10.68 27.6 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.574 -0.528 . . . . 75.31 109.574 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.38 33.89 38.02 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.8 -0.714 . . . . 73.42 112.687 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -74.47 146.84 42.46 Favored 'General case' 0 CA--C 1.485 -1.555 0 C-N-CA 119.527 -0.869 . . . . 71.14 112.155 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.438 HH21 ' HB3' ' A' ' 86' ' ' LEU . 0.1 OUTLIER -102.21 102.59 13.02 Favored 'General case' 0 N--CA 1.418 -2.054 0 CA-C-N 114.488 -1.233 . . . . 73.33 110.391 -170.503 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.504 HD11 ' CD1' ' A' ' 62' ' ' PHE . 3.9 pp -168.59 144.5 3.6 Favored 'General case' 0 C--N 1.313 -1.008 0 O-C-N 124.1 0.875 . . . . 75.3 111.22 167.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.4 p -100.42 146.91 26.44 Favored 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 106.029 -1.841 . . . . 75.21 106.029 169.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.435 HD13 HD13 ' A' ' 74' ' ' LEU . 13.9 tp -64.71 -24.54 67.6 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.334 0.587 . . . . 73.35 110.055 -177.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -48.53 -34.42 11.31 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 125.332 1.453 . . . . 74.31 110.249 173.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -82.49 -28.4 31.18 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.064 -0.971 . . . . 75.23 110.375 -175.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.448 HD23 ' CD1' ' A' ' 83' ' ' TRP . 23.2 mt -80.17 -20.08 45.63 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.183 -0.917 . . . . 73.31 110.432 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -79.72 -34.14 40.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 74.52 109.839 171.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.81 65.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.694 -0.684 . . . . 73.12 110.552 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.92 85.77 58.8 Favored Pre-proline 0 C--N 1.309 -1.152 0 N-CA-C 109.087 -0.709 . . . . 73.3 109.087 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 17.5 Cg_endo -89.45 86.9 0.43 Allowed 'Trans proline' 0 N--CA 1.422 -2.697 0 C-N-CA 121.245 1.297 . . . . 71.42 112.986 -176.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.5 p -149.75 144.29 25.96 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 104.83 -2.285 . . . . 74.31 104.83 175.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.425 ' CD2' HD11 ' A' ' 45' ' ' LEU . 67.0 mt -55.33 -39.46 70.02 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 118.743 0.701 . . . . 75.14 111.866 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -56.52 -40.12 74.49 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.164 -0.926 . . . . 72.51 111.976 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.426 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.13 -40.75 82.39 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.618 -0.23 . . . . 73.31 111.103 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.494 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 5.1 m0 -62.1 -45.23 94.41 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 107.477 -1.305 . . . . 74.12 107.477 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' A' ' 87' ' ' MET . 28.9 t30 -56.56 -53.55 56.3 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 113.912 -1.495 . . . . 72.1 110.211 177.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -60.61 -48.01 83.68 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.604 -0.725 . . . . 75.24 112.442 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB3' HH21 ' A' ' 68' ' ' ARG . 92.7 mt -59.53 -35.21 73.76 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 112.786 0.662 . . . . 72.21 112.786 -177.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.4 ' HG2' ' O ' ' A' ' 84' ' ' ASN . 20.4 ptm -82.1 -45.05 15.74 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.513 -0.475 . . . . 74.43 110.411 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.8 tp -72.58 -13.53 61.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 113.734 1.012 . . . . 75.04 113.734 -176.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.9 m -63.56 -24.86 67.98 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.465 0.65 . . . . 73.24 110.247 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.449 ' HA ' ' NE ' ' A' ' 90' ' ' ARG . 0.2 OUTLIER -132.55 -59.07 0.92 Allowed 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 113.565 0.95 . . . . 74.31 113.565 176.355 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.7 m 54.92 -174.88 0.02 OUTLIER Pre-proline 0 CA--C 1.578 2.041 0 O-C-N 124.12 0.887 . . . . 71.55 110.393 -171.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -81.57 116.69 2.95 Favored 'Trans proline' 0 N--CA 1.446 -1.307 0 N-CA-C 107.239 -1.869 . . . . 74.12 107.239 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 . . . . . 0 N--CA 1.427 -1.581 0 N-CA-C 106.809 -1.552 . . . . 75.02 106.809 -172.026 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 CA--C 1.508 -0.669 0 N-CA-C 106.524 -1.658 . . . . 74.34 106.524 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -169.15 105.03 0.39 Allowed 'General case' 0 C--O 1.219 -0.523 0 O-C-N 123.463 0.477 . . . . 75.22 109.852 176.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.484 ' HG2' ' H ' ' A' ' 17' ' ' HIS 0.339 0.0 OUTLIER -110.72 -69.19 0.88 Allowed 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 119.237 -0.985 . . . . 74.2 112.216 168.76 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.484 ' H ' ' HG2' ' A' ' 16' ' ' ARG . 42.2 m-70 -78.65 -21.08 48.89 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.974 0.731 . . . . 73.31 112.974 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.05 -15.33 8.9 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 113.701 1.0 . . . . 62.34 113.701 -176.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.66 -30.2 5.22 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 122.974 0.51 . . . . 54.22 111.326 172.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.464 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 27.3 t70 -63.33 -43.55 97.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.1 -1.074 . . . . 71.33 108.1 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.586 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 82.6 t80 -66.58 -23.01 66.14 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.114 -0.948 . . . . 75.25 110.598 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -65.25 -34.03 77.4 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.986 -0.746 . . . . 74.42 108.986 176.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -73.45 -23.75 60.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.781 -0.645 . . . . 75.32 109.79 175.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.49 ' HB2' ' CH2' ' A' ' 61' ' ' TRP . 4.3 tt -65.88 -26.66 67.73 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.722 -0.473 . . . . 75.01 109.722 173.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.587 ' NH2' ' HB3' ' A' ' 80' ' ' LEU . 2.2 mpt_? -64.81 -44.5 89.67 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 120.53 -0.468 . . . . 74.55 111.158 175.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -52.92 -51.13 62.4 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.202 0.939 . . . . 71.11 108.835 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.427 ' NE ' ' HA ' ' A' ' 27' ' ' ARG . 3.6 mmp_? -65.55 -44.04 88.06 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.124 -0.944 . . . . 73.52 111.522 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -62.49 -36.6 83.02 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.357 0.663 . . . . 73.5 111.913 -177.303 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 25' ' ' ARG . 82.9 mt -64.71 -32.88 59.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.983 0.421 . . . . 71.25 110.284 179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -84.1 -31.37 25.32 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 110.104 -0.332 . . . . 73.45 110.104 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -50.36 -54.19 23.47 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.245 1.418 . . . . 74.43 112.423 -178.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.417 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 95.2 mt -103.54 3.36 34.62 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 119.585 -0.846 . . . . 74.14 111.567 176.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 t30 56.45 69.13 0.77 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.656 1.217 . . . . 72.3 108.241 -172.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.417 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 41.1 mt -99.14 141.78 31.47 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.12 -1.4 . . . . 74.45 110.75 -172.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.6 m -79.44 146.13 65.27 Favored Pre-proline 0 C--N 1.292 -1.934 0 N-CA-C 106.237 -1.764 . . . . 75.12 106.237 175.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.98 -22.01 52.79 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 121.903 1.735 . . . . 63.22 112.677 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -88.47 -2.08 58.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.332 0.587 . . . . 74.51 110.37 177.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -112.28 -14.01 13.39 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 108.111 -1.07 . . . . 72.34 108.111 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.451 ' CD1' HD11 ' A' ' 80' ' ' LEU . 2.6 tm? -136.82 82.37 1.93 Allowed 'General case' 0 N--CA 1.418 -2.033 0 CA-C-O 122.105 0.955 . . . . 74.45 109.379 -178.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.447 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 36.8 t-80 -119.63 165.92 13.84 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 106.347 -1.723 . . . . 75.41 106.347 173.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.465 ' OE1' ' HA ' ' A' ' 81' ' ' ALA . 20.2 tp10 -43.95 -34.93 1.83 Allowed 'General case' 0 CA--C 1.573 1.86 0 C-N-CA 125.636 1.574 . . . . 75.05 113.347 -175.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -0.9 38.6 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.525 -0.735 . . . . 74.12 111.662 -173.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.2 m -69.52 138.21 53.13 Favored 'General case' 0 C--O 1.256 1.44 0 CA-C-O 121.409 0.623 . . . . 60.24 112.071 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.9 t-20 -82.32 112.99 19.8 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.441 -0.8 . . . . 73.11 110.235 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.4 mt -69.03 -34.16 74.78 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 114.536 1.31 . . . . 73.01 114.536 -175.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.5 mt -84.37 -19.8 9.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.662 0 CA-C-O 121.742 0.782 . . . . 74.21 109.664 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -76.33 -34.17 59.0 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.675 -1.232 . . . . 70.53 107.675 173.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.23 -35.73 74.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.26 -0.882 . . . . 74.2 110.213 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.1 25.57 0.8 Allowed Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 119.489 -1.339 . . . . 73.21 115.65 174.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 30.6 mt -70.61 108.93 4.59 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.616 1.208 . . . . 74.33 111.344 175.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -68.86 167.89 14.67 Favored 'General case' 0 C--O 1.246 0.913 0 N-CA-C 108.749 -0.834 . . . . 73.31 108.749 174.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.446 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 18.7 m -75.98 -14.64 60.23 Favored 'General case' 0 N--CA 1.423 -1.787 0 N-CA-C 114.754 1.39 . . . . 63.51 114.754 -174.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.543 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 47.8 mm -75.16 -45.8 40.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.467 0 N-CA-C 106.495 -1.668 . . . . 64.02 106.495 176.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -54.57 -44.39 72.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 123.675 0.61 . . . . 74.03 110.055 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 52' ' ' SER . 42.1 mt -53.2 -51.45 62.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.363 -0.835 . . . . 75.25 111.292 175.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.0 ptp -81.36 -18.6 45.04 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.301 0.852 . . . . 75.21 113.301 -177.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 30.7 mtm180 -64.55 -40.12 94.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.855 -1.165 . . . . 74.23 107.855 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -65.82 -34.17 77.53 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.545 -1.207 . . . . 74.3 111.713 176.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.4 tp -58.0 -38.83 76.85 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.147 0.499 . . . . 73.3 110.881 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.84 -41.63 64.61 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.401 -0.818 . . . . 71.11 108.896 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.49 ' CH2' ' HB2' ' A' ' 24' ' ' LEU . 62.2 t90 -55.41 -42.96 74.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.419 1.088 . . . . 65.11 111.086 -178.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -58.75 -40.71 84.65 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 122.446 1.117 . . . . 72.41 110.669 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.273 76.1 mtt180 -70.52 -12.19 61.41 Favored 'General case' 0 C--N 1.276 -2.61 0 CA-C-N 114.273 -1.33 . . . . 73.23 114.139 -170.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 9.6 mtmp? -46.31 -50.09 16.71 Favored 'General case' 0 N--CA 1.504 2.243 0 CA-C-O 121.723 0.773 . . . . 75.14 110.829 174.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.415 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 2.5 m-20 -99.01 9.0 44.46 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 114.702 -1.136 . . . . 62.31 109.842 -172.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.23 28.37 45.06 Favored Glycine 0 N--CA 1.426 -2.028 0 C-N-CA 120.638 -0.791 . . . . 73.13 112.305 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.415 ' CE1' ' HB2' ' A' ' 65' ' ' ASN . 44.3 m-85 -72.53 155.8 39.69 Favored 'General case' 0 CA--C 1.481 -1.695 0 C-N-CA 119.325 -0.95 . . . . 73.4 109.706 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -129.46 82.7 2.09 Favored 'General case' 0 C--N 1.27 -2.862 0 CA-C-N 115.165 -0.925 . . . . 74.2 111.873 -165.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.4 mt -127.91 153.27 46.87 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 115.703 -0.681 . . . . 73.52 111.223 -178.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.5 p -113.75 142.41 46.08 Favored 'General case' 0 N--CA 1.42 -1.973 0 N-CA-C 106.266 -1.753 . . . . 72.12 106.266 169.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.417 HD13 HD13 ' A' ' 74' ' ' LEU . 16.6 tp -66.96 -24.14 66.03 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.302 0.572 . . . . 74.31 110.203 -176.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -44.94 -35.13 2.7 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.817 1.647 . . . . 73.33 110.984 174.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.473 ' CD ' HH22 ' A' ' 90' ' ' ARG . 30.2 mt-10 -86.03 -28.04 24.41 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.926 -1.034 . . . . 75.24 110.43 -173.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.513 HD21 ' CG ' ' A' ' 83' ' ' TRP . 31.4 mt -81.43 -20.0 41.3 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.712 -1.131 . . . . 75.42 110.083 -174.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -79.99 -37.61 33.89 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.61 -0.723 . . . . 74.4 109.415 171.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -64.74 -46.63 81.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.455 -0.793 . . . . 73.5 110.988 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -128.37 85.8 59.48 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 109.601 -0.518 . . . . 74.23 109.601 176.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.475 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 2.9 Cg_endo -82.6 86.24 1.52 Allowed 'Trans proline' 0 N--CA 1.426 -2.454 0 C-N-CA 121.155 1.237 . . . . 75.43 111.47 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.7 p -153.9 140.95 19.36 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.651 -1.611 . . . . 74.31 106.651 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.587 ' HB3' ' NH2' ' A' ' 25' ' ' ARG . 77.9 mt -50.22 -48.84 54.24 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 123.981 0.801 . . . . 74.43 111.706 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.465 ' HA ' ' OE1' ' A' ' 41' ' ' GLU . . . -46.3 -46.54 18.1 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 124.962 1.414 . . . . 64.51 112.887 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.509 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.17 -48.44 62.2 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-O 119.09 -0.481 . . . . 73.43 111.19 -177.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.513 ' CG ' HD21 ' A' ' 74' ' ' LEU . 3.9 m0 -60.53 -38.79 85.58 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.245 -1.02 . . . . 75.31 108.245 -178.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.34 -59.24 5.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.11 -1.405 . . . . 74.5 109.903 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.442 ' NE2' ' HB2' ' A' ' 88' ' ' LEU . 25.5 tp60 -63.84 -26.44 68.62 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 123.707 0.803 . . . . 73.41 111.845 -178.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 83.3 mt -67.23 -25.67 66.21 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 111.91 0.337 . . . . 74.5 111.91 176.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.586 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 50.3 mtt -71.14 -22.69 62.03 Favored 'General case' 0 C--O 1.2 -1.533 0 C-N-CA 120.392 -0.523 . . . . 73.34 110.005 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.442 ' HB2' ' NE2' ' A' ' 85' ' ' GLN . 1.2 mm? -93.51 -12.0 30.66 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 121.071 0.463 . . . . 71.14 110.735 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.8 t -67.57 -31.08 70.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 107.253 -1.388 . . . . 74.23 107.253 171.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.486 ' HD3' ' N ' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -167.78 101.06 0.48 Allowed 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 114.782 -1.099 . . . . 73.34 110.142 174.219 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 55.4 m -81.39 -164.22 0.05 OUTLIER Pre-proline 0 C--N 1.308 -1.204 0 N-CA-C 105.917 -1.883 . . . . 64.21 105.917 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -73.12 114.38 4.02 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 CA-C-N 123.263 2.201 . . . . 74.33 106.578 168.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.267 2.006 0 N-CA-C 105.612 -1.996 . . . . 74.11 105.612 -171.261 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.604 ' OD2' ' HG3' ' A' ' 16' ' ' ARG . 15.4 t0 . . . . . 0 CA--C 1.5 -0.958 0 N-CA-C 108.045 -1.094 . . . . 73.41 108.045 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -170.97 22.57 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.978 0 O-C-N 124.393 1.058 . . . . 75.52 109.818 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.604 ' HG3' ' OD2' ' A' ' 14' ' ' ASP 0.306 0.0 OUTLIER -51.13 -45.53 61.64 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 115.354 1.613 . . . . 72.44 115.354 -176.366 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.501 ' H ' ' HD2' ' A' ' 16' ' ' ARG . 88.1 m-70 -78.72 -39.69 35.71 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.956 0.884 . . . . 75.0 111.093 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.412 ' HB2' ' OD1' ' A' ' 84' ' ' ASN . . . -64.76 -16.23 62.71 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.761 -1.109 . . . . 75.34 113.694 -174.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.07 -26.41 60.34 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.516 -0.311 . . . . 73.1 110.645 173.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.487 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 17.7 t70 -81.14 -42.83 20.29 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.2 -1.407 . . . . 73.21 107.2 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.611 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 60.7 t80 -54.48 -35.99 63.67 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.108 0.963 . . . . 72.21 112.162 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.657 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 52.3 tp60 -45.17 -52.29 9.51 Favored 'General case' 0 C--O 1.209 -1.074 0 O-C-N 124.376 1.048 . . . . 74.22 109.662 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.57 -33.23 71.17 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.44 0.696 . . . . 73.51 111.927 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.613 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 4.6 tt -66.25 -34.91 79.08 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.136 -0.69 . . . . 71.2 109.136 177.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.607 HH12 ' NE2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -83.91 -34.93 24.42 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 115.521 -0.763 . . . . 73.01 110.903 -172.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.657 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 1.4 mm-40 -63.51 -37.53 87.65 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.286 -1.005 . . . . 72.41 108.286 178.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 ttt85 -73.36 -37.4 66.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 120.024 -0.67 . . . . 74.4 110.589 173.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.536 HD11 ' CD1' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -56.42 -30.21 62.53 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.24 0.459 . . . . 74.02 112.24 -177.246 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.71 -50.41 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-O 121.317 0.579 . . . . 74.24 109.711 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -70.9 -33.22 70.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.696 -0.684 . . . . 65.53 111.259 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -47.33 -53.26 14.12 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 125.556 1.542 . . . . 72.23 112.464 -175.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.459 ' HB2' ' CD1' ' A' ' 34' ' ' LEU . 82.8 mt -107.92 10.16 28.54 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.036 -0.666 . . . . 74.24 110.911 176.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 60.56 42.22 14.43 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 121.892 0.853 . . . . 75.14 110.404 -176.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.459 ' CD1' ' HB2' ' A' ' 32' ' ' LEU . 1.5 mp -79.65 130.93 35.8 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 108.055 -1.091 . . . . 72.23 108.055 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.497 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 74.9 p -79.65 157.61 74.34 Favored Pre-proline 0 C--N 1.296 -1.733 0 N-CA-C 107.933 -1.136 . . . . 73.13 107.933 176.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -63.55 -1.7 3.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.457 2.105 . . . . 73.34 112.793 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -84.19 -26.19 28.95 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.539 -0.911 . . . . 72.11 108.539 177.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 35' ' ' THR . 15.5 pt20 -115.07 -14.09 11.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.561 -0.745 . . . . 74.23 110.432 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -108.15 94.25 4.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.931 0.872 . . . . 71.13 110.461 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.436 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 25.2 t-80 -130.73 164.53 24.89 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 102.658 -3.089 . . . . 71.44 102.658 167.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.431 ' HB2' ' N ' ' A' ' 81' ' ' ALA 0.5 9.1 pt-20 -77.87 -2.36 36.28 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 118.63 2.826 . . . . 75.24 118.63 -169.519 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -91.63 -7.3 50.41 Favored 'General case' 0 C--N 1.314 -0.949 0 O-C-N 121.26 -0.9 . . . . 74.32 108.711 177.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.7 t -66.52 140.09 57.97 Favored 'General case' 0 C--O 1.263 1.77 0 CA-C-N 114.858 -1.064 . . . . 75.42 111.186 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -86.6 111.92 21.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.224 -0.898 . . . . 74.03 108.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.4 mt -74.3 -21.36 59.76 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 113.446 0.906 . . . . 75.12 113.446 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.6 mm -71.83 -36.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.429 -0.952 . . . . 64.51 108.429 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -79.19 -17.43 54.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.082 -0.963 . . . . 75.25 109.808 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.44 -16.83 44.29 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.411 -0.813 . . . . 75.42 109.824 177.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.64 26.55 7.56 Favored Glycine 0 N--CA 1.435 -1.423 0 CA-C-N 115.55 -0.75 . . . . 74.23 114.654 175.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 tp -74.62 116.81 15.74 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 106.109 -1.811 . . . . 73.41 106.109 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -78.04 164.62 24.88 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 119.561 -0.856 . . . . 75.4 109.7 -174.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 7.6 m -70.65 -19.86 62.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 112.708 0.633 . . . . 75.52 112.708 -176.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.62 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 48.9 mm -76.67 -42.05 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 N-CA-C 106.946 -1.501 . . . . 74.14 106.946 176.052 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 tpp180 -54.82 -48.06 73.28 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.931 -1.137 . . . . 75.1 107.931 176.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.54 -47.35 79.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 113.341 -1.754 . . . . 74.51 110.397 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.409 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 19.8 ptp -81.66 -18.69 43.68 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.152 -0.619 . . . . 72.52 111.935 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 6.1 mmp_? -63.85 -40.5 96.72 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.662 -1.236 . . . . 74.15 107.662 176.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.613 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 10.8 m95 -60.93 -35.43 76.7 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.072 -1.422 . . . . 70.42 113.095 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.82 -39.13 70.92 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.497 0.665 . . . . 73.23 109.942 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -70.77 -30.67 67.22 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.857 -1.065 . . . . 55.43 109.702 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.487 ' HH2' ' O ' ' A' ' 20' ' ' ASP . 41.0 t90 -71.09 -33.91 70.63 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.739 -0.664 . . . . 74.31 109.927 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.568 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 79.1 m-85 -68.29 -59.19 3.38 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.62 -0.881 . . . . 73.33 108.62 173.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.423 ' HA ' ' O ' ' A' ' 67' ' ' TYR . 1.2 mmp_? -53.83 -24.47 15.7 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 114.373 -1.285 . . . . 74.34 112.214 -176.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 2.1 ttpm? -41.82 -50.45 4.37 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 127.041 2.136 . . . . 72.44 112.77 173.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -114.82 29.11 8.26 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 122.747 1.26 . . . . 74.23 109.281 -171.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 89.72 -11.08 71.41 Favored Glycine 0 C--O 1.248 0.978 0 CA-C-N 114.876 -1.056 . . . . 64.52 113.154 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.568 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 34.6 m-85 -61.09 159.55 11.6 Favored 'General case' 0 CA--C 1.486 -1.493 0 C-N-CA 123.088 0.555 . . . . 73.32 111.206 -178.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.586 ' NH1' ' HB2' ' A' ' 93' ' ' GLU . 16.7 ptp180 -153.19 135.31 14.82 Favored 'General case' 0 C--N 1.278 -2.514 0 C-N-CA 118.996 -1.082 . . . . 64.23 112.545 -166.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -168.48 176.45 5.76 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.039 -1.467 . . . . 74.05 107.039 168.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.5 p -113.2 142.1 46.18 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 108.128 -1.064 . . . . 73.3 108.128 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.412 HD12 HD12 ' A' ' 74' ' ' LEU . 17.9 tp -66.32 -24.33 66.52 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.115 0.483 . . . . 74.45 111.489 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.4 ppt_? -60.7 -15.76 32.42 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.779 -0.646 . . . . 75.05 110.758 178.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -86.09 -26.46 25.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.772 -0.649 . . . . 74.32 110.136 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.497 HD23 ' CD1' ' A' ' 83' ' ' TRP . 16.1 mt -82.12 -22.99 35.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.469 -0.787 . . . . 71.44 110.19 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -84.24 -32.17 24.6 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.665 -0.698 . . . . 71.43 109.718 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.35 -47.37 73.64 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.048 -0.524 . . . . 60.34 110.294 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.34 86.47 57.01 Favored Pre-proline 0 N--CA 1.432 -1.357 0 N-CA-C 108.282 -1.007 . . . . 54.14 108.282 175.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -80.77 86.47 1.64 Allowed 'Trans proline' 0 N--CA 1.427 -2.422 0 C-N-CA 121.039 1.159 . . . . 74.21 111.942 -176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.3 p -153.25 140.83 19.86 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.21 -1.404 . . . . 72.01 107.21 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.536 ' CD1' HD11 ' A' ' 28' ' ' LEU . 31.1 tp -52.43 -49.8 63.83 Favored 'General case' 0 C--N 1.289 -2.04 0 O-C-N 124.237 0.961 . . . . 64.42 111.322 -177.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.431 ' N ' ' HB2' ' A' ' 41' ' ' GLU . . . -54.95 -35.05 63.83 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.062 0.945 . . . . 75.32 112.407 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.556 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -60.59 -46.0 91.89 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 121.281 -0.168 . . . . 71.1 110.757 -178.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.497 ' CD1' HD23 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -65.94 -38.27 88.2 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 107.936 -1.135 . . . . 75.05 107.936 -176.865 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.412 ' OD1' ' HB2' ' A' ' 18' ' ' ALA . 50.1 t30 -62.28 -51.7 66.67 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 113.921 -1.49 . . . . 73.12 110.06 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.92 -28.66 64.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.684 -0.689 . . . . 73.42 111.352 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 73.3 mt -59.51 -34.6 72.82 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 112.132 0.419 . . . . 75.24 112.132 177.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.611 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 40.5 mtt -55.17 -55.7 28.23 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.167 0.508 . . . . 73.11 110.433 174.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.37 -38.81 88.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.312 -0.858 . . . . 74.4 112.163 177.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.4 m -68.22 -35.82 78.55 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 116.198 -0.456 . . . . 74.31 111.882 -177.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 16.4 mmm-85 -78.29 -48.43 15.71 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.555 -0.458 . . . . 74.42 111.1 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.433 ' HB3' ' CD ' ' A' ' 92' ' ' PRO . 66.7 m 59.79 -172.91 0.02 OUTLIER Pre-proline 0 CA--C 1.583 2.245 0 O-C-N 123.88 0.738 . . . . 61.42 110.41 -176.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.433 ' CD ' ' HB3' ' A' ' 91' ' ' SER . 3.0 Cg_exo -80.52 118.51 3.56 Favored 'Trans proline' 0 C--N 1.363 1.313 0 CA-C-N 120.848 1.339 . . . . 75.12 111.01 172.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.586 ' HB2' ' NH1' ' A' ' 68' ' ' ARG . 7.2 mt-10 . . . . . 0 C--O 1.283 2.837 0 N-CA-C 105.751 -1.944 . . . . 71.13 105.751 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 CA--C 1.518 -0.285 0 N-CA-C 106.131 -1.803 . . . . 73.33 106.131 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -140.66 24.61 2.22 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.488 -0.768 . . . . 61.31 112.269 -177.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.284 0.0 OUTLIER -57.01 -49.38 75.96 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.957 1.095 . . . . 74.02 113.957 -174.435 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.08 -36.52 48.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.582 0.706 . . . . 74.13 110.3 177.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.66 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -61.45 -15.98 42.53 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 114.376 1.25 . . . . 75.42 114.376 -174.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.84 -29.51 62.92 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 120.835 0.35 . . . . 75.55 110.961 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.532 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 27.6 t70 -70.86 -36.93 73.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 108.731 -0.84 . . . . 73.42 108.731 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.547 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 48.3 t80 -62.9 -22.71 66.93 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.314 -0.857 . . . . 70.22 111.366 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -59.17 -33.94 71.52 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.124 0.487 . . . . 73.32 109.845 178.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -69.66 -38.39 77.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.652 -0.87 . . . . 74.43 108.652 177.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.525 HD21 ' CE2' ' A' ' 21' ' ' TYR . 5.0 tt -67.59 -26.52 66.31 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.935 -0.575 . . . . 74.11 110.343 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HD3' HD13 ' A' ' 80' ' ' LEU . 22.3 mmm-85 -59.36 -56.6 19.98 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.58 -0.526 . . . . 73.53 109.58 171.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.524 ' OE1' ' HD2' ' A' ' 27' ' ' ARG . 5.1 tm-20 -50.7 -47.85 58.92 Favored 'General case' 0 CA--C 1.515 -0.367 0 O-C-N 124.705 1.253 . . . . 71.43 108.615 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.524 ' HD2' ' OE1' ' A' ' 26' ' ' GLU . 15.3 mmm180 -61.27 -48.6 80.67 Favored 'General case' 0 C--O 1.19 -2.049 0 CA-C-N 115.143 -0.935 . . . . 72.51 112.574 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.5 mt -58.58 -47.01 85.73 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.468 0.576 . . . . 75.12 111.145 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.446 HG23 ' O ' ' A' ' 34' ' ' LEU . 89.3 mt -60.57 -36.24 68.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.488 -1.233 . . . . 74.12 110.285 -177.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -84.4 -53.66 5.3 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-O 121.069 0.461 . . . . 74.23 111.08 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -63.42 -35.29 79.92 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 116.036 1.865 . . . . 72.12 116.036 -173.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.443 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 5.7 mp -96.88 -6.72 35.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 118.515 -1.274 . . . . 72.44 111.021 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.6 t30 61.32 74.16 0.45 Allowed 'General case' 0 C--O 1.246 0.884 0 CA-C-O 122.522 1.153 . . . . 74.41 108.866 -172.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.446 ' O ' HG23 ' A' ' 29' ' ' ILE . 46.2 mt -120.46 130.57 54.36 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.33 -1.359 . . . . 73.31 107.33 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 32.4 p -79.33 163.55 58.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 108.697 -0.853 . . . . 74.13 108.697 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -63.27 -20.3 70.28 Favored 'Trans proline' 0 N--CA 1.485 0.984 0 C-N-CA 121.918 1.746 . . . . 71.45 112.213 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -84.47 -25.19 29.07 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.425 0.631 . . . . 73.54 109.493 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -85.47 -43.18 13.8 Favored 'General case' 0 N--CA 1.434 -1.258 0 N-CA-C 108.479 -0.934 . . . . 75.02 108.479 -179.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.36 75.48 1.62 Allowed 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 108.718 -0.845 . . . . 71.43 108.718 177.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 50.0 t-80 -94.38 165.23 12.67 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 107.0 -1.482 . . . . 75.44 107.0 171.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.423 ' CD ' HH12 ' A' ' 25' ' ' ARG . 6.3 mm-40 -53.18 -34.47 57.06 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 114.61 1.337 . . . . 72.3 114.61 -171.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.507 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -100.72 4.44 43.1 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.786 -0.571 . . . . 73.54 110.848 -174.656 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 26.2 t -66.29 136.5 55.92 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-O 121.397 0.617 . . . . 74.54 110.859 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.437 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 43.4 t-20 -83.13 101.11 10.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.376 -0.829 . . . . 74.53 109.14 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 31.5 mt -58.53 -28.5 65.52 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 114.786 1.402 . . . . 75.12 114.786 -176.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.2 mm -68.65 -34.82 67.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.175 -0.676 . . . . 74.31 109.175 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -82.87 -10.82 58.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.176 -0.92 . . . . 74.44 109.85 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.96 -4.2 58.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.232 -0.895 . . . . 55.3 108.763 175.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.09 44.37 2.83 Favored Glycine 0 N--CA 1.43 -1.749 0 CA-C-N 114.874 -1.057 . . . . 72.41 112.81 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -100.95 97.08 7.7 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.959 -0.756 . . . . 72.42 108.959 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -68.87 170.73 9.1 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.666 -1.152 . . . . 63.52 109.567 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 21.6 m -78.32 -14.59 59.35 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 115.224 1.565 . . . . 73.31 115.224 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.9 mm -80.64 -42.76 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 106.473 -1.677 . . . . 73.41 106.473 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.515 ' O ' ' HB2' ' A' ' 57' ' ' ARG . 25.5 ttm180 -63.82 -24.59 67.81 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 115.477 -0.783 . . . . 73.52 109.531 175.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.5 tp -78.42 -37.72 43.13 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.976 -0.556 . . . . 75.5 109.541 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.4 tpp -73.99 -29.03 61.75 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.063 -1.088 . . . . 74.33 108.063 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.515 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 7.0 mmm180 -53.45 -33.07 52.76 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 113.432 -1.713 . . . . 63.3 110.523 174.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.49 ' CE3' ' HA ' ' A' ' 58' ' ' TRP . 23.1 m95 -83.6 -32.71 25.59 Favored 'General case' 0 N--CA 1.42 -1.966 0 N-CA-C 113.441 0.904 . . . . 74.13 113.441 -178.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.4 tp -59.2 -43.63 92.23 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.777 0.322 . . . . 71.45 111.035 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -76.37 -18.23 58.98 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.372 -0.531 . . . . 75.2 110.544 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.724 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 53.6 t90 -77.63 -37.32 50.37 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 109.22 -0.659 . . . . 74.33 109.22 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.661 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 88.2 m-85 -64.71 -53.86 40.65 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.886 -1.153 . . . . 75.13 107.886 172.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -12.84 3.66 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 115.808 1.781 . . . . 74.05 115.808 -175.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.724 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 32.2 mtmm -42.06 -51.45 4.53 Favored 'General case' 0 N--CA 1.528 3.438 0 C-N-CA 123.943 0.897 . . . . 71.43 112.099 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -114.12 19.69 16.22 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.014 -0.994 . . . . 62.23 109.675 -174.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 82.92 37.35 13.18 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 115.113 -0.949 . . . . 61.43 113.122 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.661 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 19.8 m-85 -75.31 164.61 26.25 Favored 'General case' 0 CA--C 1.476 -1.866 0 C-N-CA 119.704 -0.799 . . . . 74.51 109.308 172.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -132.58 107.27 8.33 Favored 'General case' 0 C--N 1.282 -2.336 0 C-N-CA 118.382 -1.327 . . . . 74.44 113.034 -162.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.415 HD23 ' CE1' ' A' ' 62' ' ' PHE . 3.1 pp -167.88 153.56 7.21 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 124.424 1.077 . . . . 74.23 111.804 165.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 p -96.2 142.9 27.81 Favored 'General case' 0 N--CA 1.408 -2.565 0 N-CA-C 107.684 -1.228 . . . . 61.12 107.684 173.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.425 HD12 HD12 ' A' ' 74' ' ' LEU . 17.9 tp -71.5 -23.85 61.87 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.796 0.665 . . . . 73.45 112.796 -171.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.471 ' HB2' ' OE1' ' A' ' 73' ' ' GLU . 21.9 mtm180 -54.41 -30.34 52.07 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.816 0.817 . . . . 71.12 108.813 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 mm-40 -76.03 -24.76 55.22 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.046 -1.434 . . . . 74.34 109.963 -169.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.425 HD12 HD12 ' A' ' 71' ' ' LEU . 25.8 mt -81.47 -17.53 48.38 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.115 -0.948 . . . . 75.24 109.378 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -82.54 -40.37 21.06 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.829 -0.804 . . . . 74.24 108.829 172.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.86 -48.57 78.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.224 -0.898 . . . . 75.41 110.786 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.82 84.73 60.37 Favored Pre-proline 0 N--CA 1.435 -1.194 0 N-CA-C 109.414 -0.587 . . . . 73.11 109.414 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.437 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 18.3 Cg_endo -87.18 86.43 0.75 Allowed 'Trans proline' 0 N--CA 1.42 -2.84 0 C-N-CA 121.035 1.157 . . . . 74.21 111.925 -177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 p -152.34 144.02 23.54 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.13 -1.433 . . . . 73.32 107.13 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.533 HD13 ' HD3' ' A' ' 25' ' ' ARG . 2.4 tm? -51.73 -50.95 59.56 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 123.989 0.806 . . . . 72.1 110.538 -177.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.82 -40.09 59.88 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 124.074 0.859 . . . . 72.04 111.745 -179.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.585 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.0 -49.44 57.78 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.284 0.365 . . . . 73.2 111.32 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.537 ' HB2' ' HH ' ' A' ' 21' ' ' TYR . 6.3 m0 -58.16 -42.31 85.69 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.696 -0.853 . . . . 73.24 108.696 -179.032 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.17 -50.18 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.449 -1.25 . . . . 74.45 111.217 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.437 ' HG2' ' HA ' ' A' ' 82' ' ' ALA . 16.1 pt20 -68.89 -27.77 66.09 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-O 119.257 -0.401 . . . . 65.23 110.141 -178.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 77.0 mt -61.03 -34.98 75.7 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 112.712 0.634 . . . . 73.13 112.712 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.66 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 40.3 mtt -53.48 -37.49 62.75 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.403 0.621 . . . . 74.3 110.487 174.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -88.7 -41.93 12.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.585 -0.734 . . . . 74.52 112.684 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.8 m -69.79 -23.61 63.37 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 122.983 0.513 . . . . 73.55 112.153 -174.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 16.6 mmm180 -81.04 -58.91 2.86 Favored 'General case' 0 CA--C 1.494 -1.2 0 C-N-CA 120.166 -0.613 . . . . 74.44 109.436 177.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . 0.301 48.9 m 67.99 -83.61 0.0 OUTLIER Pre-proline 0 CA--C 1.589 2.468 0 CA-C-O 117.621 -1.181 . . . . 74.42 111.48 -169.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -98.14 117.99 0.13 Allowed 'Trans proline' 0 C--N 1.386 2.527 0 CA-C-N 123.639 2.335 . . . . 74.32 112.452 168.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 . . . . . 0 N--CA 1.481 1.108 0 C-N-CA 125.343 1.457 . . . . 70.32 114.485 177.578 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' H ' ' CZ ' ' A' ' 16' ' ' ARG . 1.1 p30 . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 110.131 -0.322 . . . . 74.01 110.131 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -155.17 104.54 2.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 118.06 0.391 . . . . 74.35 110.177 173.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.666 ' HD3' ' C ' ' A' ' 93' ' ' GLU . 1.8 mpt_? -111.0 -67.56 0.99 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.031 0.919 . . . . 72.54 109.511 173.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -75.6 -33.35 60.54 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.331 -1.304 . . . . 73.44 111.772 -173.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -67.34 -14.33 62.82 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 114.445 -1.252 . . . . 74.33 113.902 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -53.54 -35.43 60.71 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 110.175 -0.306 . . . . 51.54 110.175 172.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.408 ' CG ' ' HZ2' ' A' ' 64' ' ' LYS . 38.3 t70 -71.81 -39.22 69.97 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 107.987 -1.116 . . . . 74.21 107.987 176.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.565 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 86.0 t80 -56.79 -22.74 38.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.18 1.392 . . . . 74.43 112.252 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.35 -44.84 88.95 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 108.453 -0.943 . . . . 74.41 108.453 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.6 mm-40 -64.55 -29.29 70.32 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.48 -0.782 . . . . 72.34 111.554 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 8.3 tt -71.77 -32.26 67.48 Favored 'General case' 0 C--O 1.196 -1.721 0 C-N-CA 120.589 -0.444 . . . . 64.33 109.827 176.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.565 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 9.6 mmm180 -76.04 -49.1 18.46 Favored 'General case' 0 CA--C 1.483 -1.623 0 N-CA-C 108.231 -1.026 . . . . 74.41 108.231 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 27' ' ' ARG . 45.2 mt-10 -51.94 -46.73 64.84 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 124.474 1.109 . . . . 75.32 110.753 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -75.8 -46.8 28.64 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 113.264 0.839 . . . . 73.34 113.264 179.335 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -67.34 -36.15 80.84 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.122 0.874 . . . . 72.51 112.082 -176.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 97.1 mt -72.52 -24.62 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-O 121.732 0.777 . . . . 74.43 109.611 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -84.04 -36.0 23.41 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.607 -0.724 . . . . 74.35 109.352 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.463 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 8.0 tp10 -46.73 -54.29 10.0 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 127.649 2.38 . . . . 75.14 113.32 -176.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.1 mt -105.86 16.63 24.91 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.738 -0.785 . . . . 74.1 111.564 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 t30 56.65 58.36 4.18 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 123.008 1.385 . . . . 74.25 108.354 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 mt -102.8 168.5 9.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 113.771 -1.559 . . . . 73.22 109.042 -176.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.415 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 10.3 p -141.19 158.63 63.85 Favored Pre-proline 0 C--N 1.279 -2.478 0 N-CA-C 105.853 -1.906 . . . . 72.13 105.853 177.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.79 -19.95 41.15 Favored 'Trans proline' 0 CA--C 1.552 1.403 0 C-N-CA 122.46 2.107 . . . . 75.12 113.397 -178.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.415 ' OE1' ' HB ' ' A' ' 35' ' ' THR . 21.9 mp0 -74.26 -32.63 63.02 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.905 0.384 . . . . 71.05 111.136 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -98.65 -31.31 11.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.168 0.508 . . . . 75.44 110.713 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.17 88.7 2.79 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.56 -1.274 . . . . 73.22 107.56 177.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -94.96 165.09 12.62 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 103.975 -2.602 . . . . 74.41 103.975 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -52.98 -42.04 65.17 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.665 0.745 . . . . 73.41 110.506 -178.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -80.79 0.19 35.91 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 125.891 1.676 . . . . 62.44 113.512 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.3 m -74.82 128.41 35.49 Favored 'General case' 0 C--O 1.247 0.957 0 C-N-CA 120.058 -0.657 . . . . 72.02 110.289 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 23.8 t-20 -73.4 114.16 11.3 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.868 -0.606 . . . . 71.2 110.198 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.6 mt -66.51 -24.38 66.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 114.335 1.235 . . . . 73.32 114.335 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.0 mm -74.97 -38.0 42.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.033 -0.728 . . . . 71.0 109.033 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -72.78 -25.12 61.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.41 -0.813 . . . . 74.21 110.286 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.94 -33.16 71.76 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.147 -0.686 . . . . 72.32 109.147 174.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.38 33.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.135 0 C-N-CA 120.28 -0.962 . . . . 71.55 115.184 174.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 40.9 mt -81.99 106.97 14.33 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 117.982 0.891 . . . . 74.33 109.663 174.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 163.78 19.11 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.72 -0.844 . . . . 73.02 108.72 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.9 p -72.24 -19.54 61.69 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 114.571 1.323 . . . . 74.23 114.571 -173.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.534 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 50.5 mm -76.61 -44.02 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.446 0 N-CA-C 106.906 -1.516 . . . . 63.53 106.906 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HD3' ' CD ' ' A' ' 31' ' ' GLU . 10.2 ttm180 -59.37 -39.14 82.33 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.261 -0.881 . . . . 73.42 108.884 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.56 -45.67 86.07 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 114.855 -1.066 . . . . 72.0 109.94 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.472 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 21.3 ptp -75.63 -18.58 59.64 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 121.95 -0.469 . . . . 72.44 111.173 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.534 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 36.4 mtm180 -63.14 -42.59 99.5 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.411 -1.329 . . . . 74.2 107.411 173.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 51.7 m95 -62.81 -35.98 81.69 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 114.474 -1.239 . . . . 74.32 112.485 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.9 tp -55.08 -40.83 70.81 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.331 0.586 . . . . 74.4 110.533 177.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -73.74 -32.09 63.68 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.536 -0.757 . . . . 71.3 110.848 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.624 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 62.6 t90 -66.41 -46.05 77.87 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.705 -0.68 . . . . 74.31 109.593 176.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -61.54 -47.97 83.13 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 122.202 1.001 . . . . 73.14 110.249 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -66.63 -12.16 56.86 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 114.476 -1.238 . . . . 72.54 113.62 -172.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 31.0 mtmm -49.67 -50.86 41.78 Favored 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 121.672 0.749 . . . . 73.33 109.859 177.126 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -102.96 21.73 15.16 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-N 114.855 -1.066 . . . . 71.35 108.158 -176.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.19 47.15 92.49 Favored Glycine 0 N--CA 1.426 -1.987 0 CA-C-N 114.069 -1.423 . . . . 74.13 112.04 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . 0.426 35.3 m-85 -61.94 151.54 34.6 Favored 'General case' 0 CA--C 1.48 -1.744 0 N-CA-C 113.895 1.072 . . . . 72.33 113.895 178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -88.67 66.06 7.97 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-N 113.731 -1.577 . . . . 75.13 112.927 -159.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -160.65 178.04 9.88 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.751 0.786 . . . . 72.34 112.82 179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.425 ' H ' ' HG3' ' A' ' 73' ' ' GLU . 12.4 m -133.7 167.75 19.96 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.359 -2.46 . . . . 72.03 104.359 177.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.3 -27.42 69.02 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 119.0 0.818 . . . . 74.44 111.236 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -55.11 -34.37 63.64 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.921 -0.77 . . . . 74.24 108.921 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.425 ' HG3' ' H ' ' A' ' 70' ' ' THR . 8.7 mm-40 -71.34 -33.07 69.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.067 -1.424 . . . . 73.44 110.013 -169.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.6 mt -78.49 -22.6 47.24 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 114.58 -1.191 . . . . 64.13 110.135 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -82.29 -39.69 22.57 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.463 -0.569 . . . . 75.44 109.463 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.94 -47.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.343 -0.844 . . . . 74.55 111.229 -178.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.01 81.58 57.16 Favored Pre-proline 0 N--CA 1.434 -1.256 0 C-N-CA 120.426 -0.51 . . . . 62.33 110.884 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.533 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 7.9 Cg_endo -87.62 87.0 0.65 Allowed 'Trans proline' 0 N--CA 1.427 -2.413 0 C-N-CA 121.53 1.487 . . . . 74.13 111.302 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.0 p -155.02 141.55 18.81 Favored 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 104.859 -2.275 . . . . 75.43 104.859 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.559 HD12 ' CD ' ' A' ' 25' ' ' ARG . 12.2 mt -61.37 -27.41 68.5 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 118.703 -1.199 . . . . 75.34 112.717 -178.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.89 73.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 123.801 0.688 . . . . 64.25 110.291 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.608 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.82 -46.33 65.88 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.569 -0.741 . . . . 71.32 110.683 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 10.9 m0 -53.89 -35.36 61.51 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.163 0.585 . . . . 75.03 111.807 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 21' ' ' TYR . 33.0 t30 -75.89 -48.73 20.21 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.271 0.558 . . . . 71.4 110.834 178.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -67.46 -23.0 65.46 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.89 -0.595 . . . . 73.33 112.273 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 77.4 mt -61.98 -24.48 67.05 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 122.104 -0.372 . . . . 75.34 111.392 176.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.8 mtt -84.5 -63.08 1.4 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.134 0.492 . . . . 73.43 110.788 174.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.729 ' HG ' ' OXT' ' A' ' 93' ' ' GLU . 7.6 mp -69.6 -16.08 63.32 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 115.93 1.826 . . . . 75.3 115.93 -175.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.6 m -108.88 9.29 26.71 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.133 -0.979 . . . . 72.21 111.338 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -126.91 4.4 6.58 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.656 0.741 . . . . 73.42 110.364 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.418 ' HB3' ' HD2' ' A' ' 92' ' ' PRO . 74.3 m -162.93 179.33 1.27 Allowed Pre-proline 0 C--N 1.304 -1.377 0 N-CA-C 104.983 -2.229 . . . . 74.22 104.983 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 91' ' ' SER . 49.6 Cg_exo -42.65 148.94 0.39 Allowed 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.096 1.864 . . . . 73.34 112.585 172.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.729 ' OXT' ' HG ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.425 0 N-CA-C 113.845 1.054 . . . . 73.02 113.845 -171.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 CA--C 1.537 0.478 0 CA-C-O 119.704 -0.189 . . . . 75.22 111.243 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.76 119.24 6.91 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 121.299 0.571 . . . . 63.33 111.43 178.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.491 ' H ' HD11 ' A' ' 88' ' ' LEU . 2.9 mpt_? -111.85 -75.75 0.61 Allowed 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.119 -1.067 . . . . 74.33 108.119 171.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.468 ' HB3' ' CE2' ' A' ' 67' ' ' TYR . 8.2 m-70 -78.01 -21.53 50.65 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.815 0.817 . . . . 72.14 110.461 174.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.532 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -60.81 -14.84 24.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 113.809 -1.541 . . . . 75.41 112.715 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.26 -29.86 10.54 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-O 121.195 0.522 . . . . 75.03 110.263 172.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -68.3 -44.79 74.69 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.652 -0.704 . . . . 75.05 109.371 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.497 ' CE2' HD22 ' A' ' 24' ' ' LEU . 68.4 t80 -64.27 -23.85 67.45 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.363 0.665 . . . . 62.23 110.736 178.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -60.01 -32.48 70.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.403 -0.592 . . . . 72.34 109.403 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.446 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 29.6 mm-40 -72.47 -43.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.886 -0.597 . . . . 74.21 110.312 176.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.497 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.3 tt -59.44 -37.24 77.6 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.907 -0.405 . . . . 70.33 109.907 177.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.515 ' HD2' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -58.54 -48.17 81.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 75.34 109.805 -179.624 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -43.93 95.88 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 115.42 -0.809 . . . . 74.31 110.922 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -62.78 -34.52 77.41 Favored 'General case' 0 C--O 1.213 -0.86 0 C-N-CA 119.567 -0.853 . . . . 73.51 111.474 177.391 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.511 ' O ' HD12 ' A' ' 34' ' ' LEU . 15.2 mt -63.41 -30.69 71.77 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.778 0.659 . . . . 73.0 112.778 176.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.431 ' CD1' HD13 ' A' ' 39' ' ' LEU . 17.3 mm -60.83 -40.09 84.02 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 108.439 -0.949 . . . . 64.24 108.439 176.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -79.33 -44.6 21.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.056 -0.52 . . . . 73.14 110.378 -178.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -44.86 -54.48 6.37 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.289 1.835 . . . . 74.14 114.996 -170.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.431 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 90.3 mt -106.49 20.28 19.22 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.702 -0.799 . . . . 72.3 111.266 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t30 59.13 53.0 5.72 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 123.204 1.478 . . . . 72.12 107.787 -175.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.511 HD12 ' O ' ' A' ' 28' ' ' LEU . 64.4 mt -95.46 -176.9 3.91 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 113.963 -1.471 . . . . 74.15 108.486 -178.02 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -152.97 148.91 20.83 Favored Pre-proline 0 C--N 1.276 -2.595 0 N-CA-C 103.469 -2.789 . . . . 75.41 103.469 -177.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -51.06 -35.13 49.88 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.867 1.711 . . . . 74.44 112.931 179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -0.8 29.76 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.141 0.496 . . . . 75.42 111.388 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.423 ' NE2' ' HA ' ' A' ' 34' ' ' LEU . 10.2 tt0 -119.9 -15.31 8.84 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.541 -0.911 . . . . 73.23 108.541 178.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.516 ' CD1' HD11 ' A' ' 80' ' ' LEU . 2.5 tm? -129.02 81.31 2.02 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 122.414 1.102 . . . . 72.53 109.235 -173.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.414 ' O ' HD13 ' A' ' 80' ' ' LEU . 12.0 m170 -96.75 166.77 11.49 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.166 -2.288 . . . . 74.5 107.884 178.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.428 ' CD ' HH21 ' A' ' 25' ' ' ARG . 10.9 mm-40 -62.78 -26.51 68.75 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.353 -1.351 . . . . 71.32 107.353 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.29 -10.55 59.84 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.799 2.039 . . . . 74.31 111.453 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.7 m -79.24 120.04 23.17 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.276 0.56 . . . . 72.32 111.784 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.536 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 44.1 t-20 -69.83 112.63 6.4 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.445 -0.946 . . . . 71.01 108.445 175.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 51.2 mt -68.4 -30.63 69.58 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 114.089 1.144 . . . . 70.3 114.089 -176.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.5 mm -71.21 -35.28 57.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 108.342 -0.984 . . . . 74.41 108.342 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -72.24 -26.3 61.96 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.719 -1.128 . . . . 70.44 109.581 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.95 -11.56 59.82 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.615 -0.72 . . . . 75.23 110.132 177.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.38 31.58 10.41 Favored Glycine 0 N--CA 1.429 -1.788 0 CA-C-N 115.668 -0.696 . . . . 75.0 113.135 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.9 tp -75.88 101.36 5.12 Favored 'General case' 0 N--CA 1.421 -1.883 0 N-CA-C 107.493 -1.299 . . . . 73.15 107.493 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.634 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 3.3 p30 -61.15 162.69 7.04 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.566 0.698 . . . . 74.45 110.187 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 56' ' ' MET . 20.0 m -74.34 -14.81 60.93 Favored 'General case' 0 N--CA 1.414 -2.231 0 N-CA-C 114.071 1.137 . . . . 71.41 114.071 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.677 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 48.1 mm -76.98 -44.38 31.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.37 0 N-CA-C 106.521 -1.659 . . . . 73.23 106.521 175.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.634 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -50.12 -49.16 52.69 Favored 'General case' 0 CA--C 1.503 -0.84 0 N-CA-C 108.692 -0.855 . . . . 72.01 108.692 175.104 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tp -58.8 -52.88 63.84 Favored 'General case' 0 CA--C 1.553 1.081 0 O-C-N 125.564 1.79 . . . . 75.04 111.151 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.439 ' HG2' ' O ' ' A' ' 52' ' ' SER . 21.6 ptp -77.07 -18.75 57.82 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.826 1.047 . . . . 74.54 113.826 -177.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.677 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.5 mtm180 -61.37 -43.26 99.17 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.528 -1.286 . . . . 75.43 107.528 174.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.417 ' O ' ' HD1' ' A' ' 62' ' ' PHE . 18.2 m95 -64.53 -32.02 73.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.948 -1.478 . . . . 75.25 111.023 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.22 -35.62 69.89 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.597 0.759 . . . . 54.41 109.308 178.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 -81.63 -41.71 21.06 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.233 -0.439 . . . . 74.14 109.824 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.575 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 81.6 t90 -51.96 -42.88 63.23 Favored 'General case' 0 C--O 1.211 -0.973 0 C-N-CA 124.599 1.16 . . . . 72.12 112.587 -177.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.417 ' HD1' ' O ' ' A' ' 58' ' ' TRP . 18.9 m-85 -63.96 -52.42 59.78 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-O 122.118 0.961 . . . . 74.23 112.642 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -63.02 -13.44 35.51 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 116.442 2.016 . . . . 75.2 116.442 -166.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.575 ' HD2' ' O ' ' A' ' 61' ' ' TRP . 0.0 OUTLIER -62.14 -22.98 66.29 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.895 0.771 . . . . 75.04 111.693 -178.916 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -113.81 24.26 12.27 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 122.562 1.172 . . . . 72.14 108.322 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.39 42.52 89.62 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 114.635 -1.166 . . . . 70.4 112.563 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 17' ' ' HIS . 21.8 m-85 -87.56 168.08 13.37 Favored 'General case' 0 CA--C 1.487 -1.475 0 C-N-CA 120.304 -0.558 . . . . 75.34 112.458 178.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.6 ttt180 -116.14 120.07 37.85 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.882 -1.054 . . . . 65.44 111.869 -170.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -168.76 138.91 2.36 Favored 'General case' 0 CA--C 1.483 -1.596 0 O-C-N 124.439 1.087 . . . . 72.31 111.035 161.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 72.0 p -103.94 142.63 34.09 Favored 'General case' 0 N--CA 1.396 -3.154 0 N-CA-C 103.464 -2.791 . . . . 72.33 103.464 165.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 13.3 tp -68.04 -23.93 65.03 Favored 'General case' 0 C--N 1.292 -1.911 0 C-N-CA 119.738 -0.785 . . . . 74.0 111.933 -171.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.687 ' HD3' ' O ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.97 -21.85 66.67 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.774 -0.824 . . . . 75.12 108.774 -179.986 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.54 -34.94 65.44 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 121.541 0.686 . . . . 72.34 109.282 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.532 HD23 ' CD1' ' A' ' 83' ' ' TRP . 12.6 mt -73.25 -29.95 63.12 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.266 -0.879 . . . . 73.43 109.523 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -84.34 4.43 31.26 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.595 -0.73 . . . . 74.45 110.49 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.73 -53.14 3.38 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.613 -0.884 . . . . 74.2 108.613 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.42 88.36 54.29 Favored Pre-proline 0 N--CA 1.43 -1.455 0 N-CA-C 107.863 -1.162 . . . . 73.22 107.863 175.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.536 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 18.5 Cg_endo -82.59 86.81 1.45 Allowed 'Trans proline' 0 N--CA 1.427 -2.384 0 C-N-CA 121.018 1.145 . . . . 75.41 112.494 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.1 p -154.6 156.79 37.18 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 105.266 -2.124 . . . . 63.25 105.266 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.516 HD11 ' CD1' ' A' ' 39' ' ' LEU . 57.3 mt -57.08 -45.11 83.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.561 0.696 . . . . 74.12 110.955 -179.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -44.83 -44.93 9.86 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 113.433 -1.712 . . . . 65.35 113.129 -176.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -62.07 -48.6 79.49 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 123.073 0.233 . . . . 71.22 111.528 -178.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.532 ' CD1' HD23 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -68.87 -34.08 74.84 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 107.916 -1.142 . . . . 73.0 107.916 -174.078 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -60.85 -50.2 74.41 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.624 -1.171 . . . . 74.5 109.125 177.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.43 -17.49 63.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.622 -0.717 . . . . 74.12 112.085 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 71.7 mt -68.41 -20.28 64.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.392 0.615 . . . . 74.2 110.692 176.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.532 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 57.3 mtt -81.93 -39.24 24.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 120.514 -0.474 . . . . 75.21 110.235 173.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.491 HD11 ' H ' ' A' ' 16' ' ' ARG . 2.9 mm? -73.46 -27.2 61.28 Favored 'General case' 0 C--O 1.194 -1.83 0 N-CA-C 112.677 0.621 . . . . 73.1 112.677 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.7 p -81.23 12.52 3.46 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.77 0.795 . . . . 71.54 111.155 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.41 -0.68 6.28 Favored 'General case' 0 N--CA 1.401 -2.915 0 C-N-CA 126.069 1.748 . . . . 74.33 108.593 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.9 m -140.69 -179.84 1.09 Allowed Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.147 -0.686 . . . . 74.24 109.147 -173.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -79.56 156.15 24.73 Favored 'Trans proline' 0 C--O 1.252 1.19 0 C-N-CA 121.398 1.399 . . . . 71.2 110.441 170.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 C--N 1.305 -1.337 0 N-CA-C 107.139 -1.43 . . . . 75.13 107.139 -179.999 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 . . . . . 0 CA--C 1.514 -0.424 0 N-CA-C 106.486 -1.672 . . . . 72.25 106.486 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -144.59 28.66 1.29 Allowed 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.378 0.423 . . . . 71.42 109.875 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.595 ' HD2' ' N ' ' A' ' 17' ' ' HIS 0.285 0.0 OUTLIER -55.56 -34.84 65.11 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.285 1.587 . . . . 74.13 115.285 -172.685 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.595 ' N ' ' HD2' ' A' ' 16' ' ' ARG . 67.3 m170 -78.51 -42.57 29.21 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.516 1.151 . . . . 64.35 109.726 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -67.76 -15.37 63.6 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 114.062 -1.426 . . . . 72.34 113.526 -173.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.31 -30.09 66.4 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.577 -0.283 . . . . 73.2 111.234 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -82.68 -27.03 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.525 0.678 . . . . 65.51 109.597 176.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.502 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 84.7 t80 -58.83 -26.75 64.45 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.752 -0.658 . . . . 73.22 109.648 174.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -58.84 -34.61 71.76 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.345 -0.843 . . . . 53.11 109.815 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -66.01 -36.87 84.45 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.484 0.659 . . . . 74.54 109.747 177.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.474 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.7 tt -67.33 -33.58 75.55 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 115.451 -0.795 . . . . 73.22 109.296 175.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -78.86 -44.3 23.19 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.443 -0.798 . . . . 73.13 112.014 -172.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.84 -44.26 81.93 Favored 'General case' 0 N--CA 1.427 -1.624 0 O-C-N 124.074 0.859 . . . . 70.45 109.944 174.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.509 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 33.5 mtp180 -64.19 -42.95 96.45 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 120.305 -0.558 . . . . 70.32 111.435 174.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' A' ' 24' ' ' LEU . 1.3 tt -51.64 -38.16 53.53 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.165 0.986 . . . . 73.4 111.144 -177.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.1 mt -66.99 -36.55 77.41 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.986 -0.552 . . . . 74.23 111.785 178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -80.68 -33.27 35.58 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.67 -0.644 . . . . 74.02 111.299 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 79.9 mm-40 -48.26 -53.51 16.9 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.036 0.934 . . . . 72.13 113.397 -177.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.487 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 81.6 mt -102.6 13.55 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.237 -0.985 . . . . 75.21 111.457 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 57.4 44.51 21.44 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.706 1.241 . . . . 74.22 109.339 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.487 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 38.8 mt -79.75 131.07 35.83 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 114.379 -1.282 . . . . 75.33 110.86 -174.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -79.78 145.87 63.21 Favored Pre-proline 0 C--N 1.287 -2.129 0 N-CA-C 106.541 -1.651 . . . . 73.11 106.541 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.09 -29.08 81.85 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 C-N-CA 122.037 1.825 . . . . 55.44 112.556 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -77.91 -13.17 59.97 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.138 0.494 . . . . 75.21 110.682 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.435 ' OE1' ' HA ' ' A' ' 34' ' ' LEU . 65.6 tt0 -95.66 -46.59 6.55 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 108.251 -1.018 . . . . 75.03 108.251 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.05 76.47 2.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 108.845 -0.798 . . . . 75.14 108.845 178.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -76.22 165.37 24.98 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 106.908 -1.515 . . . . 72.41 106.908 169.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.75 -51.75 5.23 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.923 1.083 . . . . 74.4 113.923 -172.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -105.13 26.09 9.75 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 113.532 0.938 . . . . 73.22 113.532 -178.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 22.2 t -59.63 134.38 56.97 Favored 'General case' 0 C--O 1.245 0.862 0 N-CA-C 108.631 -0.877 . . . . 74.23 108.631 175.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.466 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 0.9 OUTLIER -73.01 99.14 2.66 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.998 -0.546 . . . . 75.13 110.835 -177.531 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.5 mt -55.45 -38.81 69.53 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.71 1.004 . . . . 74.34 113.71 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.9 mm -63.83 -35.14 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-O 121.055 0.455 . . . . 72.52 110.361 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -85.84 -10.86 54.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.215 0.531 . . . . 73.02 110.385 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -86.91 -12.39 47.84 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.829 -0.804 . . . . 75.15 108.829 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.48 22.96 7.47 Favored Glycine 0 N--CA 1.436 -1.348 0 CA-C-N 115.239 -0.891 . . . . 73.14 114.436 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.83 99.65 1.41 Allowed 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.704 -1.221 . . . . 75.13 107.704 176.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -64.47 153.24 39.45 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.557 -1.201 . . . . 71.52 108.833 178.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.423 ' O ' ' HG2' ' A' ' 56' ' ' MET . 37.5 m -72.26 -14.45 61.77 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 113.914 1.079 . . . . 72.13 113.914 -175.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.611 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 50.8 mm -75.29 -47.35 35.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 118.421 -1.312 . . . . 75.31 107.847 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.429 ' NE ' ' HB3' ' A' ' 31' ' ' GLU . 32.7 ttm105 -63.9 -35.93 82.27 Favored 'General case' 0 N--CA 1.438 -1.045 0 O-C-N 123.574 0.546 . . . . 75.54 109.619 178.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.7 -49.86 73.88 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.03 -0.986 . . . . 72.5 109.064 176.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 52' ' ' SER . 19.5 ptp -80.73 -18.23 48.45 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.444 -0.502 . . . . 72.45 111.803 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.611 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 6.4 mmp_? -62.14 -40.13 94.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 107.921 -1.14 . . . . 74.34 107.921 176.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -63.43 -37.05 85.8 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.565 -1.198 . . . . 73.52 111.59 177.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.81 -34.77 73.49 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.674 0.75 . . . . 75.04 109.781 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.615 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 45.7 m80 -72.14 -34.32 68.43 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.096 -0.956 . . . . 74.34 110.175 177.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 t90 -66.66 -58.55 4.89 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 124.594 1.183 . . . . 75.45 109.953 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.4 ' CZ ' HD23 ' A' ' 69' ' ' LEU . 53.8 m-85 -44.89 -55.23 5.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.746 0.818 . . . . 75.24 112.273 -177.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.315 86.1 mtt-85 -71.22 -12.67 61.59 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 115.203 1.557 . . . . 75.51 115.203 -173.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 44.1 mmtm -82.44 -35.38 27.6 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.871 -0.788 . . . . 74.23 108.871 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -80.77 -9.32 59.82 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.895 -1.048 . . . . 71.1 110.422 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.73 -3.24 52.88 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.841 -0.618 . . . . 60.53 112.567 177.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -83.01 160.86 21.89 Favored 'General case' 0 CA--C 1.483 -1.634 0 CA-C-O 121.048 0.451 . . . . 74.52 110.963 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 53.9 mtt180 -145.05 131.64 19.87 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.822 -0.751 . . . . 74.44 112.575 -167.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.4 HD23 ' CZ ' ' A' ' 62' ' ' PHE . 3.1 pp -168.8 172.78 7.59 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 125.421 1.488 . . . . 75.11 107.193 170.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.0 p -116.54 149.84 38.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.974 -1.491 . . . . 74.11 106.974 171.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.427 HD12 HD13 ' A' ' 74' ' ' LEU . 10.9 tp -66.42 -24.0 66.39 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 112.054 0.39 . . . . 75.45 112.054 -173.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 55.5 mtm180 -52.18 -32.46 36.21 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.885 0.85 . . . . 73.1 109.479 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -78.92 -27.69 43.78 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.092 -1.413 . . . . 75.0 110.182 -173.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.445 HD23 ' CD1' ' A' ' 83' ' ' TRP . 17.0 mt -82.47 -17.79 44.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.289 -0.869 . . . . 74.41 110.158 -178.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -82.72 -35.92 26.28 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.86 -0.609 . . . . 74.14 109.447 173.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -42.2 85.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.532 -0.758 . . . . 64.41 110.626 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.38 90.75 23.93 Favored Pre-proline 0 N--CA 1.434 -1.253 0 N-CA-C 109.117 -0.697 . . . . 61.15 109.117 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.466 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 36.7 Cg_endo -93.63 85.82 0.16 Allowed 'Trans proline' 0 N--CA 1.422 -2.691 0 C-N-CA 121.035 1.157 . . . . 75.31 112.184 -179.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 38.9 p -147.49 174.03 12.1 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 104.859 -2.274 . . . . 73.23 104.859 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.5 mt -76.77 -44.07 34.39 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 120.431 1.469 . . . . 72.34 112.366 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.479 ' O ' ' HG3' ' A' ' 85' ' ' GLN . . . -60.73 -31.47 70.78 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.868 -0.605 . . . . 43.45 112.356 -173.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.569 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -59.41 -55.42 34.93 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.318 0.386 . . . . 64.41 110.99 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.458 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -63.5 -39.18 93.77 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.681 -1.229 . . . . 73.02 107.681 -176.455 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -57.88 -50.37 73.54 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.6 -1.636 . . . . 75.11 110.694 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 81' ' ' ALA . 78.2 mt-30 -75.5 -32.12 60.42 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 116.156 -0.474 . . . . 74.41 111.295 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 92.6 mt -57.08 -32.25 66.07 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.348 0.499 . . . . 71.1 112.348 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.502 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 43.5 mtt -57.5 -52.08 66.86 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.468 0.651 . . . . 71.13 110.328 173.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -71.98 -36.28 69.74 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.873 0.694 . . . . 75.34 112.873 178.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.3 m -63.94 -22.29 66.86 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.611 0.569 . . . . 71.53 111.585 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.501 ' O ' ' HD2' ' A' ' 92' ' ' PRO . 54.4 mmt-85 -79.1 -74.89 0.26 Allowed 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 120.515 -0.474 . . . . 65.53 111.179 174.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . 0.303 45.6 m 62.03 -90.11 0.0 OUTLIER Pre-proline 0 CA--C 1.593 2.601 0 CA-C-O 117.461 -1.257 . . . . 64.52 111.002 -168.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 88.7 Cg_endo -87.28 153.85 8.05 Favored 'Trans proline' 0 C--N 1.388 2.642 0 CA-C-N 123.494 2.284 . . . . 71.14 111.507 170.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.474 ' OE1' ' HD3' ' A' ' 68' ' ' ARG . 21.2 tt0 . . . . . 0 N--CA 1.431 -1.378 0 N-CA-C 100.933 -3.729 . . . . 70.42 100.933 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.3 t70 . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 105.911 -1.885 . . . . 63.21 105.911 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.409 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 15.2 m120 88.98 100.62 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 126.301 1.841 . . . . 72.25 114.097 173.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.351 0.0 OUTLIER -110.47 -76.19 0.61 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 119.532 -0.867 . . . . 74.21 113.148 171.905 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -79.02 -31.52 44.7 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 103.973 -2.603 . . . . 75.12 103.973 168.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 15' ' ' ASN . . . -50.61 -14.25 0.18 Allowed 'General case' 0 C--O 1.204 -1.335 0 CA-C-N 112.166 -2.288 . . . . 74.43 112.242 170.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -48.11 -21.96 0.56 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.487 0.715 . . . . 74.21 112.19 174.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.546 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 29.8 t70 -60.53 -30.17 69.58 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 122.336 1.065 . . . . 62.22 109.856 172.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.617 ' CE2' HD22 ' A' ' 24' ' ' LEU . 67.3 t80 -70.21 -21.54 63.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.53 -0.759 . . . . 64.42 110.004 177.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.451 ' HB2' ' O ' ' A' ' 19' ' ' ALA . 14.7 mm100 -68.19 -30.06 69.06 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.233 -0.655 . . . . 74.22 109.233 174.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.546 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 0.3 OUTLIER -69.1 -36.37 77.48 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.07 -1.085 . . . . 74.5 108.07 174.148 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.617 HD22 ' CE2' ' A' ' 21' ' ' TYR . 6.9 tt -68.32 -37.06 80.22 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.583 -0.735 . . . . 71.44 109.561 172.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.417 ' HE ' ' HG ' ' A' ' 80' ' ' LEU . 1.8 mpt_? -54.12 -49.08 70.0 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.761 0.424 . . . . 71.22 111.216 176.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -50.71 -60.85 2.63 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.814 1.321 . . . . 75.11 108.69 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -69.72 -28.13 65.56 Favored 'General case' 0 N--CA 1.417 -2.08 0 N-CA-C 113.17 0.804 . . . . 75.22 113.17 -177.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -42.39 95.77 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 121.092 -1.005 . . . . 73.43 109.406 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.8 -42.04 82.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.293 -0.867 . . . . 74.54 109.312 177.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.01 -52.33 65.96 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 124.718 1.207 . . . . 74.51 111.09 178.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -69.25 -29.01 66.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.665 0.987 . . . . 74.34 113.665 -170.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.8 mt -97.45 3.13 50.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 118.955 -1.098 . . . . 74.22 112.944 170.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.99 45.88 14.3 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.911 1.339 . . . . 60.12 108.229 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.3 mt -88.34 -176.36 5.33 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.331 -1.304 . . . . 75.34 109.066 -179.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.5 m -140.43 148.27 52.99 Favored Pre-proline 0 C--N 1.28 -2.426 0 N-CA-C 105.537 -2.023 . . . . 73.5 105.537 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -55.66 -28.47 66.04 Favored 'Trans proline' 0 N--CA 1.491 1.328 0 C-N-CA 122.196 1.931 . . . . 74.33 112.371 177.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -76.61 -10.85 59.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.212 -0.449 . . . . 73.4 111.117 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -102.46 -23.39 13.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.087 -0.708 . . . . 75.42 109.087 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.6 tp -138.7 98.72 3.63 Favored 'General case' 0 N--CA 1.418 -2.05 0 C-N-CA 119.994 -0.682 . . . . 73.54 112.73 -172.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -106.8 166.38 10.63 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 105.027 -2.212 . . . . 72.05 105.027 169.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.534 ' HA ' ' HB3' ' A' ' 80' ' ' LEU 0.508 17.0 pt-20 -64.5 -13.7 53.54 Favored 'General case' 0 CA--C 1.555 1.154 0 N-CA-C 117.518 2.414 . . . . 74.45 117.518 -171.713 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.62 -6.11 52.77 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 120.807 -1.183 . . . . 74.02 109.661 -179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -75.48 141.17 43.14 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-N 115.618 -0.719 . . . . 70.33 111.975 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.554 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 3.7 m-20 -77.11 118.92 20.13 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.262 -0.881 . . . . 72.43 112.577 -178.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.433 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 25.6 mt -79.07 -33.97 44.1 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 114.704 1.372 . . . . 73.31 114.704 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.1 mm -69.27 -26.5 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-O 121.779 0.8 . . . . 72.42 109.477 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -85.16 -10.85 56.23 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.175 -0.92 . . . . 74.4 110.122 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -86.39 -19.74 29.27 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.747 -0.834 . . . . 72.21 108.747 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.57 29.7 3.3 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 115.432 -0.804 . . . . 73.42 115.053 174.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.433 ' CD1' ' HB3' ' A' ' 45' ' ' LEU . 72.8 mt -73.35 108.43 6.22 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 117.694 0.747 . . . . 73.34 110.482 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -67.8 163.47 21.69 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.751 -1.203 . . . . 64.14 107.751 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -72.8 -14.61 61.56 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 115.875 1.805 . . . . 74.52 115.875 -173.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.3 mm -86.24 -36.78 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 C-N-CA 117.991 -1.484 . . . . 71.05 107.746 176.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -65.34 -29.26 69.97 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 107.899 -1.148 . . . . 75.13 107.899 176.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.7 tp -73.96 -52.74 11.88 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.291 -1.322 . . . . 75.15 108.76 176.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.5 ttm -72.55 -22.62 60.98 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 113.13 0.789 . . . . 74.21 113.13 -174.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -64.83 -28.79 69.8 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.664 -0.814 . . . . 71.31 109.486 176.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.577 ' CZ3' ' HG ' ' A' ' 24' ' ' LEU . 16.8 m95 -71.06 -33.71 70.52 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.702 -0.681 . . . . 74.11 111.434 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.03 -37.55 74.57 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.501 0.667 . . . . 74.02 110.323 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -70.86 -44.27 66.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.942 -1.026 . . . . 75.43 109.808 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.519 ' CZ2' ' HB2' ' A' ' 24' ' ' LEU . 51.8 t90 -54.24 -53.69 50.13 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.588 1.155 . . . . 75.12 109.666 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.418 ' CD2' HD23 ' A' ' 69' ' ' LEU . 43.7 m-85 -54.17 -50.19 67.58 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.603 0.716 . . . . 74.25 112.275 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -77.32 -13.44 59.93 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 115.584 -0.735 . . . . 64.41 112.465 -174.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.733 ' HA ' ' NZ ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -83.31 -41.06 18.7 Favored 'General case' 0 C--N 1.312 -1.055 0 O-C-N 121.729 -0.607 . . . . 71.24 111.891 171.241 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -78.21 -11.2 59.91 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.032 0.833 . . . . 63.54 112.427 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.04 40.19 3.84 Favored Glycine 0 C--O 1.245 0.811 0 C-N-CA 120.385 -0.912 . . . . 50.25 112.739 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -114.47 167.13 10.99 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 122.488 -0.419 . . . . 75.22 111.884 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 53.7 ttt180 -128.91 94.19 3.78 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.447 0.536 . . . . 73.23 112.447 -166.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.418 HD23 ' CD2' ' A' ' 62' ' ' PHE . 1.4 pt? -167.74 161.83 13.55 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 109.715 -0.476 . . . . 75.44 109.715 175.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.735 ' HB ' ' OE2' ' A' ' 73' ' ' GLU . 2.6 m -116.6 165.19 13.54 Favored 'General case' 0 N--CA 1.417 -2.118 0 N-CA-C 107.082 -1.451 . . . . 72.3 107.082 174.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.447 HD11 HD12 ' A' ' 74' ' ' LEU . 14.8 tp -79.89 -23.91 41.54 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 112.287 0.477 . . . . 75.44 112.287 -174.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -67.98 -25.32 65.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 74.42 110.681 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.735 ' OE2' ' HB ' ' A' ' 70' ' ' THR . 2.2 mp0 -75.54 -34.98 60.79 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.597 -1.183 . . . . 73.25 108.668 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.572 HD23 ' CD1' ' A' ' 83' ' ' TRP . 56.8 mt -68.94 -17.44 63.95 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 113.018 -1.901 . . . . 75.11 112.133 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -81.79 -41.44 21.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.502 -0.555 . . . . 74.04 109.502 173.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.4 -43.72 80.63 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.315 -0.857 . . . . 72.24 110.653 -176.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -123.82 84.99 53.93 Favored Pre-proline 0 N--CA 1.428 -1.527 0 N-CA-C 107.947 -1.131 . . . . 71.42 107.947 175.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.554 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 58.0 Cg_endo -90.98 85.4 0.33 Allowed 'Trans proline' 0 N--CA 1.415 -3.139 0 C-N-CA 120.601 0.868 . . . . 73.14 112.338 -175.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 p -141.41 145.92 35.93 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.155 -0.929 . . . . 63.53 108.644 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 41' ' ' GLU . 45.5 tp -60.3 -25.08 65.48 Favored 'General case' 0 C--N 1.279 -2.489 0 O-C-N 123.973 0.796 . . . . 72.35 112.007 -178.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.44 -37.88 50.65 Favored 'General case' 0 C--O 1.213 -0.821 0 C-N-CA 122.717 0.407 . . . . 72.33 110.968 176.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -60.06 -47.63 85.05 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 121.438 -0.105 . . . . 70.04 110.877 -177.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.572 ' CD1' HD23 ' A' ' 74' ' ' LEU . 5.8 m0 -58.84 -41.23 86.44 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.33 -0.989 . . . . 72.21 108.33 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -64.77 -52.49 56.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.239 -1.346 . . . . 74.53 110.976 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -59.77 -32.71 70.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.94 0.496 . . . . 75.24 111.436 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 93.7 mt -68.89 -23.28 64.18 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.431 0.634 . . . . 74.14 111.26 177.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 83' ' ' TRP . 90.8 mtp -79.68 -34.37 40.31 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 122.091 -0.381 . . . . 64.24 109.986 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.07 -13.32 62.16 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 121.604 0.716 . . . . 73.33 109.667 172.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.5 m -86.56 0.54 54.14 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 121.347 0.594 . . . . 74.35 110.387 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -73.94 -41.83 61.46 Favored 'General case' 0 N--CA 1.425 -1.693 0 CA-C-O 121.072 0.463 . . . . 74.23 110.063 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 49.5 m -163.69 147.25 8.22 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 106.308 -1.738 . . . . 73.44 106.308 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -57.85 135.85 71.63 Favored 'Trans proline' 0 C--O 1.24 0.592 0 C-N-CA 122.255 1.97 . . . . 61.3 112.366 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 . . . . . 0 N--CA 1.428 -1.536 0 N-CA-C 105.356 -2.091 . . . . 72.23 105.356 -179.462 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.4 t70 . . . . . 0 CA--C 1.496 -1.121 0 N-CA-C 106.551 -1.648 . . . . 75.23 106.551 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.521 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 43.7 m-80 -150.64 117.78 5.97 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.624 0.577 . . . . 73.45 109.472 -178.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -82.71 15.31 2.69 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 112.462 0.541 . . . . 75.34 112.462 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -66.14 -20.56 66.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.959 -1.126 . . . . 54.41 107.959 172.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.4 -16.6 0.2 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.121 1.769 . . . . 74.15 112.604 174.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.57 -29.44 51.25 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 122.888 0.475 . . . . 64.14 110.318 173.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.457 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 31.7 t70 -64.07 -40.97 97.44 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.029 -0.73 . . . . 74.51 109.029 175.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.525 ' CE1' HD21 ' A' ' 24' ' ' LEU . 90.9 t80 -60.32 -22.85 63.7 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.636 0.774 . . . . 73.34 111.168 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -70.93 -21.58 62.34 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.632 -0.427 . . . . 75.21 110.224 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.602 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 67.5 mt-30 -75.4 -39.44 59.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.162 -1.051 . . . . 62.3 108.162 172.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.525 HD21 ' CE1' ' A' ' 21' ' ' TYR . 3.6 tt -59.95 -38.68 83.13 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 108.251 -1.018 . . . . 73.21 108.251 175.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.472 ' HD2' HD11 ' A' ' 80' ' ' LEU . 2.8 tpp180 -62.21 -47.83 82.71 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.052 -0.976 . . . . 72.5 110.14 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -51.69 -54.59 26.52 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.188 0.995 . . . . 72.02 110.169 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.602 ' HD2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -75.18 -18.59 60.14 Favored 'General case' 0 C--O 1.205 -1.257 0 C-N-CA 119.61 -0.836 . . . . 70.42 112.142 -177.749 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -25.9 64.4 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.714 0.293 . . . . 63.41 110.492 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 20.4 mm -62.88 -44.32 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 107.945 -1.132 . . . . 71.51 107.945 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -77.42 -34.32 54.74 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.144 -0.935 . . . . 70.51 111.335 -177.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.561 ' CD ' ' HD2' ' A' ' 54' ' ' ARG . 7.8 tp10 -44.6 -53.99 6.57 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 126.133 1.773 . . . . 72.21 113.357 -175.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.0 mt -113.86 13.65 18.43 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 119.986 -0.686 . . . . 73.33 110.566 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 54.52 65.89 1.38 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 122.716 1.246 . . . . 74.13 108.648 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.8 mt -100.48 132.66 45.74 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 114.401 -1.272 . . . . 74.22 110.306 -173.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.3 m -72.12 145.72 88.95 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 106.082 -1.821 . . . . 44.31 106.082 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.96 -29.55 21.6 Favored 'Trans proline' 0 N--CA 1.488 1.181 0 C-N-CA 122.703 2.269 . . . . 73.54 113.419 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.3 -14.21 60.48 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 122.735 0.414 . . . . 71.11 111.642 178.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 20.6 tp60 -104.98 -11.16 16.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.01 -0.737 . . . . 74.53 109.01 178.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.425 ' CD1' HD13 ' A' ' 80' ' ' LEU . 2.2 tm? -132.26 71.84 1.48 Allowed 'General case' 0 N--CA 1.432 -1.332 0 CA-C-O 122.21 1.005 . . . . 74.41 109.557 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.533 ' O ' HD12 ' A' ' 80' ' ' LEU . 42.5 t-80 -118.31 165.34 13.97 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 106.652 -1.61 . . . . 74.41 106.652 173.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.404 ' OE1' ' HA ' ' A' ' 81' ' ' ALA . 7.5 tp10 -44.04 -40.48 4.83 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 125.064 1.345 . . . . 65.02 113.338 -173.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.485 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -95.79 -2.72 47.09 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.966 -0.458 . . . . 74.45 111.651 -172.907 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.2 m -69.69 138.25 52.78 Favored 'General case' 0 C--O 1.248 1.012 0 CA-C-O 121.324 0.583 . . . . 64.31 112.031 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.538 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.1 t-20 -79.88 120.07 23.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.461 -0.791 . . . . 72.11 110.861 -177.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 mt -79.05 -29.46 43.49 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 114.348 1.24 . . . . 74.12 114.348 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.1 mm -74.13 -29.99 26.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.14 -1.059 . . . . 70.3 108.14 177.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -31.54 71.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.419 -1.264 . . . . 75.4 109.641 176.014 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.62 -19.41 52.71 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.506 -0.77 . . . . 55.01 110.579 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.09 31.1 6.36 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.924 -0.655 . . . . 73.01 113.806 177.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tp -75.85 114.62 14.67 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.754 -1.202 . . . . 75.3 107.754 177.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -79.72 172.84 13.24 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.46 -0.496 . . . . 74.31 109.875 -175.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.435 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 18.9 m -78.52 -15.76 58.23 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.419 1.266 . . . . 71.21 114.419 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.577 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 49.6 mm -76.12 -40.32 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.556 0 N-CA-C 105.655 -1.979 . . . . 60.55 105.655 174.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.561 ' HD2' ' CD ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -53.17 -50.77 63.92 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.909 -1.145 . . . . 75.32 107.909 176.377 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 52' ' ' SER . 67.7 mt -53.46 -51.55 62.36 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 113.992 -1.458 . . . . 75.42 111.988 176.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.473 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 21.7 ptp -77.97 -18.19 56.29 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 113.179 0.807 . . . . 73.14 113.179 -177.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.577 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 49.5 mtm180 -64.36 -44.93 89.88 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.176 -1.416 . . . . 74.43 107.176 173.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.479 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 17.1 m95 -64.45 -30.4 71.44 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.307 -1.315 . . . . 72.43 112.268 179.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.9 tp -56.75 -37.06 70.51 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.808 0.814 . . . . 74.42 110.781 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -79.12 -23.23 44.18 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.286 -0.87 . . . . 75.5 110.649 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.457 ' HH2' ' O ' ' A' ' 20' ' ' ASP . 28.2 t90 -77.2 -30.59 54.82 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.717 -0.674 . . . . 73.22 109.352 -179.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.406 ' CE2' HD13 ' A' ' 69' ' ' LEU . 37.1 m-85 -69.68 -53.65 17.58 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-O 122.188 0.994 . . . . 74.33 108.609 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -62.43 -14.42 40.61 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 113.477 -1.692 . . . . 74.21 111.241 -174.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -50.94 -42.97 60.12 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.159 1.784 . . . . 73.01 111.035 173.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.486 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 3.1 m-20 -109.23 8.85 25.95 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 109.58 -0.526 . . . . 74.35 109.58 -177.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 8.93 64.25 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 120.447 -0.882 . . . . 75.02 112.657 -177.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.486 ' CE1' ' HB2' ' A' ' 65' ' ' ASN . 59.2 m-85 -67.05 151.35 47.79 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 109.161 -0.681 . . . . 72.44 109.161 178.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.5 mtp180 -143.6 129.79 19.76 Favored 'General case' 0 C--N 1.274 -2.708 0 N-CA-C 113.556 0.947 . . . . 71.03 113.556 -168.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.406 HD13 ' CE2' ' A' ' 62' ' ' PHE . 3.7 pp -166.28 163.06 17.66 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-N 113.631 -1.622 . . . . 74.31 107.714 174.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.1 p -100.74 142.77 31.75 Favored 'General case' 0 N--CA 1.409 -2.476 0 N-CA-C 106.629 -1.619 . . . . 73.43 106.629 173.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.433 HD13 HD13 ' A' ' 74' ' ' LEU . 15.2 tp -67.01 -24.71 66.05 Favored 'General case' 0 C--N 1.293 -1.878 0 CA-C-O 120.708 0.29 . . . . 71.53 111.629 -173.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -66.51 -18.65 65.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 74.45 110.863 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.407 ' CD ' HH22 ' A' ' 90' ' ' ARG . 36.3 mt-10 -76.3 -29.4 57.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.767 0.794 . . . . 74.22 109.318 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.544 HD23 ' CD1' ' A' ' 83' ' ' TRP . 16.3 mt -77.31 -20.13 55.42 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.758 -1.11 . . . . 72.24 110.468 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -82.77 -37.98 23.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 74.54 109.387 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.04 -43.74 95.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.576 -0.738 . . . . 72.11 110.6 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.62 84.4 63.46 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 107.829 -1.174 . . . . 64.03 107.829 174.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.538 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 56.7 Cg_endo -79.89 86.57 1.65 Allowed 'Trans proline' 0 N--CA 1.434 -2.017 0 C-N-CA 121.187 1.258 . . . . 72.53 112.237 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.4 p -153.16 160.59 42.88 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 105.864 -1.902 . . . . 74.34 105.864 -179.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 40' ' ' HIS . 64.2 mt -61.86 -44.63 96.43 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.585 0.707 . . . . 73.14 109.733 175.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.404 ' HA ' ' OE1' ' A' ' 41' ' ' GLU . . . -44.51 -44.17 8.44 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.22 -1.809 . . . . 62.32 113.281 -177.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.63 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -62.95 -49.14 75.91 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 120.908 -0.317 . . . . 61.54 111.438 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.544 ' CD1' HD23 ' A' ' 74' ' ' LEU . 1.7 m0 -61.4 -46.2 91.15 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.033 -1.099 . . . . 74.24 108.033 -175.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.65 -55.52 33.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.192 -1.367 . . . . 72.22 110.448 -179.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.77 -33.07 73.42 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.913 0.338 . . . . 74.53 111.913 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 95.1 mt -65.41 -28.8 69.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.838 0.352 . . . . 63.24 111.282 178.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.408 ' HG3' ' O ' ' A' ' 83' ' ' TRP . 76.3 mtp -80.88 -28.62 35.91 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 116.404 -0.362 . . . . 63.11 110.28 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 15' ' ' ASN . 7.4 mp -74.69 -30.96 61.74 Favored 'General case' 0 CA--C 1.502 -0.884 0 C-N-CA 119.498 -0.881 . . . . 72.41 110.362 174.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.1 m -78.77 -43.34 25.76 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.906 -0.588 . . . . 74.33 110.848 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.407 HH22 ' CD ' ' A' ' 73' ' ' GLU . 22.0 mtm180 -125.01 41.76 3.44 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 113.168 0.803 . . . . 73.41 113.168 -173.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.466 ' HB3' ' HD3' ' A' ' 92' ' ' PRO . 44.0 t -60.74 -52.14 74.66 Favored Pre-proline 0 C--N 1.284 -2.253 0 C-N-CA 118.741 -1.184 . . . . 72.02 110.006 168.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 91' ' ' SER . 39.6 Cg_endo -108.99 117.59 0.03 OUTLIER 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 121.785 1.657 . . . . 71.45 111.605 171.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 . . . . . 0 C--N 1.297 -1.692 0 N-CA-C 105.176 -2.157 . . . . 74.21 105.176 177.28 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 CA--C 1.507 -0.694 0 N-CA-C 105.48 -2.045 . . . . 73.12 105.48 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.497 ' OD1' ' HA ' ' A' ' 19' ' ' ALA . 23.8 t30 -168.29 24.33 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 118.415 0.552 . . . . 73.02 110.587 179.176 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -81.8 -77.57 0.22 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 117.734 -1.586 . . . . 75.55 109.736 178.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -79.74 -26.35 40.78 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.837 -1.542 . . . . 74.2 106.837 170.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.623 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -63.4 -13.58 41.33 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.171 -2.286 . . . . 73.01 112.6 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.497 ' HA ' ' OD1' ' A' ' 15' ' ' ASN . . . -50.31 -33.4 19.99 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.969 0.414 . . . . 70.43 110.904 173.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.413 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 29.9 t70 -66.35 -44.72 82.45 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 108.134 -1.061 . . . . 73.42 108.134 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.572 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 71.0 t80 -62.29 -22.82 66.33 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 114.649 -1.159 . . . . 71.05 110.805 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.16 -33.69 76.02 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.448 -0.575 . . . . 73.33 109.448 176.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.563 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -74.03 -36.92 64.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.173 -0.467 . . . . 70.33 109.819 175.526 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.551 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.6 tt -63.2 -37.02 85.6 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.937 -0.764 . . . . 74.44 108.937 174.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.432 HH11 ' HB3' ' A' ' 80' ' ' LEU . 3.2 tpp180 -58.78 -52.25 66.51 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 123.792 0.837 . . . . 75.24 109.781 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -56.24 -47.14 79.1 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-N 115.376 -0.829 . . . . 63.23 109.37 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 14.9 mmp_? -61.62 -46.24 90.63 Favored 'General case' 0 C--O 1.198 -1.648 0 CA-C-N 115.026 -0.988 . . . . 74.04 110.151 179.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.433 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 1.2 tt -59.91 -38.8 83.37 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.585 0.754 . . . . 75.01 111.261 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.448 HG12 HD21 ' A' ' 39' ' ' LEU . 61.4 mt -59.82 -49.03 85.41 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-O 120.884 0.373 . . . . 73.1 110.164 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.424 ' H ' ' HG2' ' A' ' 30' ' ' GLN . 7.3 pt20 -77.75 -19.2 55.55 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 112.715 0.635 . . . . 74.41 112.715 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 11.3 tp10 -55.94 -53.11 60.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.687 1.195 . . . . 74.45 110.707 176.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.494 ' HB2' ' CD1' ' A' ' 34' ' ' LEU . 96.4 mt -97.32 -3.97 39.47 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 119.529 -0.868 . . . . 75.5 111.405 175.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 71.57 42.91 0.63 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.845 0.858 . . . . 72.14 110.493 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.494 ' CD1' ' HB2' ' A' ' 32' ' ' LEU . 3.2 mp -83.1 -179.85 7.54 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 107.984 -1.117 . . . . 72.03 107.984 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 37.6 p -130.49 158.67 73.84 Favored Pre-proline 0 C--N 1.285 -2.207 0 N-CA-C 106.305 -1.739 . . . . 74.42 106.305 173.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -66.57 -1.65 6.09 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 C-N-CA 121.969 1.779 . . . . 74.0 112.027 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -81.08 -22.02 39.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.849 -0.797 . . . . 63.51 108.849 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -121.53 9.21 10.21 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.426 -0.806 . . . . 74.31 109.879 -177.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.448 HD21 HG12 ' A' ' 29' ' ' ILE . 28.1 tp -142.83 105.66 4.52 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.644 -0.822 . . . . 73.24 112.083 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -131.1 167.37 19.23 Favored 'General case' 0 C--N 1.287 -2.151 0 C-N-CA 125.7 1.6 . . . . 75.24 107.201 176.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -42.19 -39.8 2.16 Favored 'General case' 0 CA--C 1.561 1.38 0 C-N-CA 124.617 1.167 . . . . 73.43 113.897 -177.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -5.71 57.1 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.943 -0.473 . . . . 74.22 111.912 -171.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.403 ' O ' ' HA ' ' A' ' 79' ' ' THR . 16.5 m -68.78 128.79 37.92 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 121.264 0.554 . . . . 65.42 111.828 -175.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.521 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 43.1 t-20 -74.4 116.02 14.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.442 -0.799 . . . . 72.05 110.315 -179.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.416 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 54.6 mt -79.11 -23.86 43.79 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.98 1.474 . . . . 74.1 114.98 -175.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.3 mm -75.87 -35.55 30.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 N-CA-C 108.757 -0.831 . . . . 73.41 108.757 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -76.83 -15.5 59.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.296 -0.865 . . . . 72.02 110.162 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.15 -21.32 46.65 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.835 -0.802 . . . . 72.14 108.835 175.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.97 25.58 5.58 Favored Glycine 0 N--CA 1.43 -1.76 0 N-CA-C 115.112 0.805 . . . . 74.32 115.112 174.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.416 ' CD1' ' HB3' ' A' ' 45' ' ' LEU . 65.3 mt -73.25 109.24 6.62 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 118.168 0.984 . . . . 73.44 110.154 174.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.433 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.0 p30 -71.97 169.64 15.49 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.253 -1.017 . . . . 75.55 108.253 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 56' ' ' MET . 28.3 m -74.11 -14.61 61.0 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 115.104 1.52 . . . . 71.4 115.104 -172.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.447 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.5 mm -78.17 -38.44 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 C-N-CA 117.62 -1.632 . . . . 73.32 107.891 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 4.8 mmm-85 -58.42 -46.23 86.89 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 106.172 -1.788 . . . . 75.02 106.172 177.317 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.3 tp -59.96 -47.23 86.64 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.008 -1.906 . . . . 71.22 111.438 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' A' ' 52' ' ' SER . 19.9 ptp -83.55 -18.55 37.97 Favored 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 120.046 -0.662 . . . . 74.43 112.022 -176.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 36.8 mtm105 -63.4 -36.99 85.55 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.696 -0.853 . . . . 73.42 108.696 172.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.43 ' CE3' ' HA ' ' A' ' 58' ' ' TRP . 10.8 m95 -65.7 -32.25 73.71 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.508 -1.224 . . . . 74.52 112.54 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.2 tp -58.13 -31.49 67.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.488 0.661 . . . . 73.11 110.959 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -81.65 -30.99 32.54 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.186 -0.461 . . . . 74.11 109.936 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.618 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 23.7 t90 -70.1 -33.0 71.32 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.725 -0.67 . . . . 72.55 111.129 -175.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.453 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 72.4 m-85 -64.54 -47.78 77.52 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.108 0.956 . . . . 75.42 110.906 177.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.549 ' HA ' ' O ' ' A' ' 67' ' ' TYR . 58.6 mtm180 -64.59 -13.19 52.06 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 115.479 1.659 . . . . 72.11 115.479 -169.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 18.8 mtmm -52.52 -45.67 66.37 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 121.639 0.733 . . . . 73.43 110.561 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -95.82 11.28 34.19 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 115.056 -0.974 . . . . 71.31 110.571 -171.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 87.68 8.87 72.73 Favored Glycine 0 N--CA 1.429 -1.773 0 C-N-CA 120.155 -1.021 . . . . 54.14 111.195 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.549 ' O ' ' HA ' ' A' ' 63' ' ' ARG . 23.4 m-85 -74.75 158.61 33.23 Favored 'General case' 0 CA--C 1.473 -2.016 0 N-CA-C 109.001 -0.74 . . . . 74.02 109.001 176.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.626 ' NH2' ' HB2' ' A' ' 93' ' ' GLU . 10.6 ptm180 -155.14 135.78 13.48 Favored 'General case' 0 C--N 1.257 -3.452 0 CA-C-N 114.99 -1.005 . . . . 74.22 110.999 -167.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -167.95 163.91 13.8 Favored 'General case' 0 C--N 1.29 -2.011 0 O-C-N 124.444 1.09 . . . . 74.22 108.341 171.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 62.0 p -101.73 142.33 33.23 Favored 'General case' 0 N--CA 1.412 -2.334 0 N-CA-C 107.505 -1.294 . . . . 63.42 107.505 173.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.45 HD11 HD12 ' A' ' 74' ' ' LEU . 15.1 tp -64.58 -24.49 67.62 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.748 0.785 . . . . 73.34 109.826 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.526 ' C ' ' HD2' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -51.58 -27.5 11.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.622 1.569 . . . . 74.32 110.4 174.483 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -85.3 -28.27 25.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.954 -0.566 . . . . 74.52 110.457 -177.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.471 HD22 ' CD1' ' A' ' 83' ' ' TRP . 15.9 mt -78.32 -22.91 47.39 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.547 -0.751 . . . . 74.52 110.238 -178.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -78.85 -38.27 38.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.993 -0.549 . . . . 73.12 109.644 172.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.69 84.44 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.587 -0.733 . . . . 73.21 110.816 -178.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.44 86.11 58.92 Favored Pre-proline 0 N--CA 1.43 -1.428 0 N-CA-C 109.028 -0.73 . . . . 72.53 109.028 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.521 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 40.9 Cg_endo -86.78 86.43 0.81 Allowed 'Trans proline' 0 N--CA 1.425 -2.538 0 C-N-CA 121.041 1.161 . . . . 74.13 112.45 -176.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.403 ' HA ' ' O ' ' A' ' 43' ' ' SER . 15.3 p -152.84 152.32 31.43 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 105.618 -1.993 . . . . 73.32 105.618 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.432 ' HB3' HH11 ' A' ' 25' ' ' ARG . 43.4 mt -54.67 -47.25 73.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 118.637 0.653 . . . . 71.13 111.255 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.09 -40.43 23.26 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 114.207 -1.361 . . . . 75.32 112.778 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.44 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -65.42 -49.55 68.77 Favored 'General case' 0 C--O 1.208 -1.123 0 O-C-N 123.479 0.487 . . . . 73.24 111.753 -178.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.471 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -66.01 -38.3 88.12 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 106.993 -1.484 . . . . 74.04 106.993 -176.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -57.41 -51.47 69.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.199 -1.819 . . . . 71.01 111.276 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -73.34 -31.24 63.85 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 116.413 -0.358 . . . . 74.11 111.117 -179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 78.7 mt -60.26 -38.9 84.94 Favored 'General case' 0 C--O 1.19 -2.048 0 N-CA-C 113.246 0.832 . . . . 74.42 113.246 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.623 ' SD ' ' HA ' ' A' ' 18' ' ' ALA 0.264 16.7 ptp -67.84 -35.23 78.21 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 117.86 -1.536 . . . . 72.25 112.305 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.16 -46.04 71.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 120.428 -0.509 . . . . 74.13 111.927 171.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.6 t -70.88 -27.02 63.5 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 111.962 0.356 . . . . 53.44 111.962 -177.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -103.89 21.24 16.67 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.852 -0.158 . . . . 75.41 110.791 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 71.1 m -61.62 123.53 77.25 Favored Pre-proline 0 N--CA 1.44 -0.927 0 N-CA-C 106.676 -1.602 . . . . 71.24 106.676 172.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -7.4 116.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.375 1.955 1 C-N-CA 126.753 4.969 . . . . 75.45 118.417 -163.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.626 ' HB2' ' NH2' ' A' ' 68' ' ' ARG . 11.0 mt-10 . . . . . 0 N--CA 1.44 -0.963 0 N-CA-C 104.367 -2.457 . . . . 63.34 104.367 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 t0 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 107.676 -1.231 . . . . 72.13 107.676 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.517 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 17.5 m120 -142.96 108.95 5.19 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 112.071 0.397 . . . . 55.11 112.071 -171.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' A' ' 93' ' ' GLU . 0.4 OUTLIER -111.64 -76.81 0.59 Allowed 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.109 -1.071 . . . . 74.02 108.109 173.702 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.759 ' HB3' ' HB3' ' A' ' 93' ' ' GLU . 14.3 t-80 -79.31 -32.95 43.57 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 105.409 -2.071 . . . . 61.54 105.409 169.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.517 ' HB3' ' HA ' ' A' ' 15' ' ' ASN . . . -52.26 -14.29 0.43 Allowed 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 111.979 -2.373 . . . . 62.34 111.946 173.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.17 -21.78 0.54 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.769 0.828 . . . . 73.42 112.122 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.77 -45.44 74.25 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 108.509 -0.923 . . . . 73.14 108.509 171.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.516 ' CE1' HD22 ' A' ' 24' ' ' LEU . 82.4 t80 -59.85 -25.32 64.93 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.616 -0.72 . . . . 70.44 111.072 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -62.4 -41.29 98.55 Favored 'General case' 0 C--O 1.191 -2.003 0 N-CA-C 108.584 -0.895 . . . . 64.11 108.584 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -66.11 -33.01 74.82 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 123.347 0.404 . . . . 72.13 111.974 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.545 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 4.6 tt -61.93 -37.49 84.87 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 108.44 -0.948 . . . . 73.44 108.44 173.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.439 ' HA ' ' HB2' ' A' ' 28' ' ' LEU . 52.6 ttp180 -84.46 -37.59 21.18 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.012 -0.995 . . . . 75.24 111.802 -173.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -58.11 -40.03 80.14 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.367 -0.833 . . . . 72.34 109.224 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -72.24 -42.92 65.1 Favored 'General case' 0 N--CA 1.432 -1.337 0 C-N-CA 120.498 -0.481 . . . . 71.35 110.408 172.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 25' ' ' ARG . 1.2 tt -51.0 -35.58 34.78 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.335 1.054 . . . . 54.34 112.404 -177.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -58.29 -51.32 72.68 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 CA-C-O 120.616 0.246 . . . . 70.02 111.239 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.7 mp0 -81.2 -19.14 43.92 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.586 -0.445 . . . . 62.3 112.068 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -55.28 -53.38 56.8 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.43 0.692 . . . . 72.35 110.63 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.0 mt -97.53 -0.6 45.66 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 119.379 -0.929 . . . . 73.54 111.174 174.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 t30 61.15 69.66 0.65 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.476 1.132 . . . . 73.42 108.745 -172.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 mt -103.86 150.98 23.65 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.287 -1.324 . . . . 71.31 109.65 -176.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 m -83.93 147.79 52.29 Favored Pre-proline 0 C--N 1.289 -2.04 0 N-CA-C 106.9 -1.519 . . . . 73.5 106.9 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -55.14 -29.4 65.89 Favored 'Trans proline' 0 N--CA 1.487 1.11 0 C-N-CA 121.943 1.762 . . . . 73.35 112.426 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.71 -0.18 37.23 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 121.107 0.479 . . . . 71.23 110.48 177.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -116.39 -4.82 11.78 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 107.932 -1.136 . . . . 71.03 107.932 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -142.84 78.44 1.61 Allowed 'General case' 0 N--CA 1.421 -1.901 0 CA-C-O 122.227 1.013 . . . . 71.55 111.161 -175.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.424 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 30.0 t-80 -120.94 165.46 15.2 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 104.093 -2.558 . . . . 71.55 104.093 169.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 80' ' ' LEU 0.464 8.0 pt-20 -60.36 -16.68 37.42 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 117.897 2.555 . . . . 73.2 117.897 -171.724 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -93.16 -11.2 33.35 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.675 0.67 . . . . 74.15 109.908 -179.007 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 m -64.46 136.62 57.26 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-N 115.571 -0.74 . . . . 73.35 110.422 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.434 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . 3.7 m-20 -81.87 126.74 32.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.313 0.578 . . . . 74.24 110.68 -176.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.422 HD11 HD23 ' A' ' 80' ' ' LEU . 75.5 mt -77.56 -35.54 53.04 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 113.976 1.102 . . . . 72.21 113.976 -176.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.453 HG12 ' CB ' ' A' ' 78' ' ' PRO . 48.2 mm -71.49 -26.55 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 108.304 -0.999 . . . . 73.21 108.304 175.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.434 ' OE1' ' HB2' ' A' ' 44' ' ' ASN . 53.2 tt0 -69.48 -32.74 71.84 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.617 -1.174 . . . . 71.43 109.336 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.31 -13.36 55.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.416 -0.811 . . . . 74.21 110.879 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.46 35.45 6.95 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.998 -0.62 . . . . 71.32 113.499 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.6 tp -74.24 106.41 5.87 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.585 -0.894 . . . . 74.14 108.585 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.585 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 3.7 p30 -64.24 163.35 12.95 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.069 -0.969 . . . . 72.13 110.673 -178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.438 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 19.8 m -74.74 -14.08 60.68 Favored 'General case' 0 N--CA 1.416 -2.163 0 N-CA-C 114.125 1.158 . . . . 72.15 114.125 -176.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.595 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 46.3 mm -73.42 -42.55 56.7 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.354 0 N-CA-C 106.704 -1.591 . . . . 75.22 106.704 175.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.585 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 3.4 mpt_? -56.63 -47.03 80.58 Favored 'General case' 0 CA--C 1.507 -0.702 0 O-C-N 123.545 0.528 . . . . 72.11 109.662 174.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 51' ' ' ASP . 65.6 mt -53.22 -47.0 69.34 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.083 -0.962 . . . . 70.32 110.831 177.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 66.7 mtt -81.11 -19.06 44.42 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.546 0.573 . . . . 53.41 112.546 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 4.1 mmp_? -73.97 -42.0 61.12 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.44 0.638 . . . . 75.21 109.351 177.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.545 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 8.8 m95 -64.64 -28.36 69.56 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.436 -1.257 . . . . 72.52 113.781 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.87 -39.08 73.67 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 120.969 0.414 . . . . 72.23 110.896 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -69.52 -32.44 71.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.012 -0.54 . . . . 74.02 109.937 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.537 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 2.7 t90 -72.62 -29.96 63.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.472 -0.785 . . . . 74.12 110.044 -175.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.427 ' CD2' HD11 ' A' ' 69' ' ' LEU . 64.2 m-85 -73.12 -53.29 11.4 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-O 121.747 0.784 . . . . 71.04 110.516 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -64.92 -14.85 61.07 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.851 -1.068 . . . . 74.52 111.062 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -48.9 -46.82 43.39 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.334 1.854 . . . . 73.2 111.85 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.495 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 3.5 m-20 -104.67 14.47 29.72 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-O 121.611 0.719 . . . . 52.14 109.221 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.83 16.98 76.09 Favored Glycine 0 N--CA 1.417 -2.574 0 CA-C-N 115.298 -0.865 . . . . 73.25 112.423 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.495 ' CE1' ' HB2' ' A' ' 65' ' ' ASN . 43.1 m-85 -63.22 159.91 16.73 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 117.524 0.662 . . . . 65.22 110.126 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.405 ' HD2' ' N ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -125.94 91.88 3.48 Favored 'General case' 0 C--N 1.285 -2.199 0 C-N-CA 117.856 -1.538 . . . . 73.3 112.982 -160.104 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.427 HD11 ' CD2' ' A' ' 62' ' ' PHE . 3.7 pp -158.1 165.61 34.57 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 119.708 -0.797 . . . . 73.33 111.667 176.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.7 p -120.72 144.67 48.11 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.258 -1.016 . . . . 54.24 108.258 176.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.499 HD12 HD12 ' A' ' 74' ' ' LEU . 33.8 tp -62.04 -25.17 67.52 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.037 0.754 . . . . 65.42 113.037 -174.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.429 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 19.5 ptt180 -56.34 -25.82 50.47 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 121.43 0.633 . . . . 73.12 109.464 178.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 72' ' ' ARG . 40.3 mt-10 -86.09 -23.16 26.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.143 -0.935 . . . . 64.42 109.817 -173.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.515 HD22 ' CG ' ' A' ' 83' ' ' TRP . 19.3 mt -83.41 -24.55 31.87 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.009 -0.996 . . . . 73.31 109.31 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -78.68 -42.77 27.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.333 -0.848 . . . . 73.2 109.653 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.89 -47.01 87.51 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.543 -0.753 . . . . 44.33 111.38 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.75 87.27 56.88 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 108.536 -0.913 . . . . 65.41 108.536 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.453 ' CB ' HG12 ' A' ' 46' ' ' ILE . 58.9 Cg_endo -85.83 85.82 1.05 Allowed 'Trans proline' 0 N--CA 1.422 -2.721 0 C-N-CA 120.658 0.906 . . . . 74.45 112.756 -175.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.5 p -151.29 144.06 24.42 Favored 'General case' 0 C--N 1.288 -2.067 0 N-CA-C 105.806 -1.924 . . . . 73.22 105.806 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 41' ' ' GLU . 52.4 mt -52.92 -45.81 67.78 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 123.771 0.67 . . . . 75.22 110.698 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.88 -43.8 39.38 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 114.427 -1.26 . . . . 40.32 112.05 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.603 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.5 -51.96 63.33 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.765 -0.374 . . . . 64.31 110.826 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.515 ' CG ' HD22 ' A' ' 74' ' ' LEU . 3.3 m0 -60.19 -36.68 78.18 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 122.031 0.92 . . . . 75.1 108.734 -176.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -71.41 -51.26 24.98 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.449 -1.251 . . . . 75.44 111.54 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -71.23 -18.82 62.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 112.095 0.406 . . . . 73.22 112.095 -176.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 92.6 mt -63.02 -19.05 63.99 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.91 0.386 . . . . 74.5 110.792 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 62.6 mtt -77.17 -61.51 1.96 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.597 -0.89 . . . . 73.23 108.597 173.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.448 HD22 ' H ' ' A' ' 88' ' ' LEU . 2.4 mm? -62.98 -31.34 72.44 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.751 1.019 . . . . 53.34 113.751 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.2 t -79.78 -5.62 55.69 Favored 'General case' 0 C--N 1.311 -1.106 0 O-C-N 121.904 -0.498 . . . . 63.01 111.943 -175.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -115.54 -1.22 12.82 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.251 0.548 . . . . 75.24 111.62 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.8 p 179.71 118.37 0.21 Allowed Pre-proline 0 N--CA 1.432 -1.328 0 N-CA-C 106.319 -1.734 . . . . 45.23 106.319 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.77 117.43 4.76 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 120.954 1.103 . . . . 72.03 110.514 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.759 ' HB3' ' HB3' ' A' ' 17' ' ' HIS . 27.7 mt-10 . . . . . 0 C--O 1.27 2.141 0 N-CA-C 107.321 -1.363 . . . . 65.32 107.321 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 . . . . . 0 C--O 1.214 -0.81 0 N-CA-C 108.646 -0.872 . . . . 73.54 108.646 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 45.51 37.35 3.03 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 125.279 1.432 . . . . 55.43 113.846 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -56.98 -48.24 78.88 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.734 1.013 . . . . 72.12 113.734 -176.107 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -77.8 -39.19 44.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.752 0.787 . . . . 71.25 110.049 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.457 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -64.8 -15.56 61.87 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.475 -1.239 . . . . 71.53 113.705 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -53.27 -38.61 63.22 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.2 0.2 . . . . 62.43 111.175 174.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 38.5 t70 -76.63 -26.29 54.74 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 109.092 -0.707 . . . . 73.31 109.092 177.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.515 ' CE2' HD22 ' A' ' 24' ' ' LEU . 65.6 t80 -63.9 -22.78 67.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.266 -0.425 . . . . 71.03 110.133 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -60.08 -36.58 77.69 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.291 -0.633 . . . . 74.14 109.291 176.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.425 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 5.7 tt0 -64.34 -42.56 96.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.601 -0.727 . . . . 72.13 109.47 176.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.515 HD22 ' CE2' ' A' ' 21' ' ' TYR . 5.9 tt -66.1 -40.07 90.48 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.693 -0.484 . . . . 72.23 109.693 177.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.603 ' HD2' HD13 ' A' ' 80' ' ' LEU . 2.7 tpp85 -60.79 -48.1 83.32 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.147 -0.686 . . . . 74.41 109.147 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 28.6 tt0 -49.76 -48.94 50.01 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.698 1.599 . . . . 70.24 110.159 177.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.482 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 89.0 mtt180 -81.94 -18.44 43.55 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 113.86 1.059 . . . . 74.44 113.86 -173.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 28' ' ' LEU . 28.0 mt -70.92 -38.16 72.93 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 120.277 -0.569 . . . . 74.32 110.059 171.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.475 HG23 ' O ' ' A' ' 34' ' ' LEU . 62.2 mt -62.81 -39.95 86.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 107.842 -1.17 . . . . 71.01 107.842 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -61.9 -59.34 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 114.762 -1.108 . . . . 63.02 111.654 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 27' ' ' ARG . 50.3 mt-10 -55.6 -54.45 43.96 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 113.906 1.076 . . . . 70.42 113.906 -173.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.571 HD11 HD23 ' A' ' 50' ' ' LEU . 88.3 mt -97.17 6.65 48.11 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.012 -1.075 . . . . 72.22 113.042 -174.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 54.36 45.03 28.01 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 122.86 1.314 . . . . 63.41 108.914 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.509 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 37.6 mt -79.33 129.96 34.98 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 114.479 -1.237 . . . . 72.45 108.66 -175.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.8 m -70.82 141.95 87.71 Favored Pre-proline 0 N--CA 1.421 -1.896 0 N-CA-C 106.069 -1.826 . . . . 74.51 106.069 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.52 -30.1 52.7 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.284 1.99 . . . . 73.52 112.606 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 -68.35 -25.02 64.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.201 -0.454 . . . . 72.21 110.94 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.449 ' O ' ' HB3' ' A' ' 43' ' ' SER . 49.4 tt0 -89.57 -38.96 13.59 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.718 -0.845 . . . . 71.42 108.718 177.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.509 HD23 HD13 ' A' ' 34' ' ' LEU . 1.7 tm? -88.06 65.28 8.13 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-O 123.018 1.39 . . . . 73.52 110.262 -175.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -96.68 164.14 12.71 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 112.892 -1.958 . . . . 72.05 106.381 175.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 11.4 mm-40 -51.53 -29.91 18.55 Favored 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 122.101 0.953 . . . . 74.22 110.906 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -80.26 -10.05 59.75 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 127.731 2.412 . . . . 75.55 112.795 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.555 ' O ' ' HA ' ' A' ' 79' ' ' THR . 54.1 p -64.59 119.2 10.04 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 112.899 0.703 . . . . 74.41 112.899 -176.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.523 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 42.8 t-20 -73.92 105.26 5.1 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.25 -1.018 . . . . 75.42 108.25 174.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.507 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 76.7 mt -70.32 -23.02 62.77 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 114.822 1.416 . . . . 72.43 114.822 -174.27 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.447 HG12 ' CB ' ' A' ' 78' ' ' PRO . 46.0 mm -73.53 -39.87 54.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.539 -0.911 . . . . 73.24 108.539 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -77.37 -18.08 57.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.185 -0.916 . . . . 71.24 110.052 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.5 -27.27 55.97 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.17 -0.678 . . . . 75.51 109.17 175.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.65 38.46 0.91 Allowed Glycine 0 N--CA 1.434 -1.473 0 C-N-CA 120.511 -0.852 . . . . 41.32 115.103 175.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.571 HD23 HD11 ' A' ' 32' ' ' LEU . 34.4 mt -89.21 103.25 15.89 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.385 -0.969 . . . . 75.25 108.385 173.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.586 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 4.0 p30 -67.8 159.04 31.1 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.624 -0.88 . . . . 74.23 108.624 177.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.5 m -66.57 -17.98 65.12 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.52 1.304 . . . . 53.52 114.52 -175.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 51.5 mm -77.12 -48.23 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.808 0 C-N-CA 117.821 -1.552 . . . . 75.23 107.909 178.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.586 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 29.2 mtp180 -65.54 -35.05 79.7 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 123.904 0.752 . . . . 73.41 110.755 177.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.483 ' HG ' HD11 ' A' ' 71' ' ' LEU . 14.3 tp -57.88 -44.18 86.51 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.393 -0.965 . . . . 70.42 108.393 175.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 53.5 ttm -81.22 -20.28 41.41 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.26 -0.882 . . . . 71.14 111.125 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 5.4 mmp_? -65.37 -40.59 93.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.73 -1.211 . . . . 74.55 107.73 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -62.53 -33.14 74.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.12 -1.4 . . . . 74.13 111.801 176.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.9 tp -57.11 -43.52 82.36 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 120.741 0.305 . . . . 71.15 110.576 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -67.23 -36.54 81.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.315 0.579 . . . . 73.42 109.612 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.624 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 70.8 t90 -64.25 -36.61 84.64 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.136 -0.938 . . . . 73.31 110.259 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.52 ' CD1' HD11 ' A' ' 69' ' ' LEU . 49.7 m-85 -70.38 -58.23 3.97 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.454 0.645 . . . . 65.42 111.453 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.448 ' NH2' ' HA ' ' A' ' 68' ' ' ARG . 0.9 OUTLIER -65.01 -16.1 63.06 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.251 -0.886 . . . . 72.3 112.085 -172.693 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.8 pttm -56.27 -39.59 72.88 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.932 0.493 . . . . 75.22 111.608 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.465 ' HB3' ' CE1' ' A' ' 67' ' ' TYR . 66.1 t30 -114.93 24.79 11.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 122.33 1.062 . . . . 63.21 108.285 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.37 26.17 73.94 Favored Glycine 0 N--CA 1.437 -1.249 0 CA-C-N 114.432 -1.258 . . . . 63.2 114.159 177.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.465 ' CE1' ' HB3' ' A' ' 65' ' ' ASN . 60.9 m-85 -69.98 142.33 52.85 Favored 'General case' 0 CA--C 1.475 -1.906 0 CA-C-N 118.072 0.936 . . . . 72.23 110.394 177.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.507 ' NH1' ' HA ' ' A' ' 69' ' ' LEU . 0.0 OUTLIER -98.32 91.54 5.27 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 114.971 -1.013 . . . . 74.3 112.196 -163.949 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.564 HD22 HD21 ' A' ' 74' ' ' LEU . 4.5 pp -168.28 148.9 4.86 Favored 'General case' 0 CA--C 1.486 -1.484 0 O-C-N 123.928 0.768 . . . . 64.45 111.22 168.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.574 ' HB ' ' OE1' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -103.75 168.71 8.96 Favored 'General case' 0 N--CA 1.399 -3.009 0 N-CA-C 103.74 -2.689 . . . . 54.01 103.74 171.426 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.525 HD12 HD12 ' A' ' 74' ' ' LEU . 14.0 tp -79.28 -23.75 43.38 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 119.317 -0.953 . . . . 61.25 112.176 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 24.6 tpt85 -60.34 -27.72 67.58 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 120.696 0.284 . . . . 75.51 110.402 -178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.574 ' OE1' ' HB ' ' A' ' 70' ' ' THR . 2.6 mp0 -71.94 -40.01 69.02 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.976 0.894 . . . . 65.04 109.849 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.564 HD21 HD22 ' A' ' 69' ' ' LEU . 15.8 mt -67.81 -27.94 67.15 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.22 -1.355 . . . . 75.14 110.636 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.439 ' CZ ' HD23 ' A' ' 55' ' ' LEU . 54.8 m-85 -84.0 -3.64 58.15 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.014 -0.539 . . . . 74.2 110.819 173.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.93 -49.32 5.35 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.173 -0.677 . . . . 75.32 109.173 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.96 88.72 53.79 Favored Pre-proline 0 N--CA 1.429 -1.496 0 N-CA-C 108.334 -0.987 . . . . 72.24 108.334 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.523 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 10.8 Cg_endo -88.27 86.59 0.58 Allowed 'Trans proline' 0 N--CA 1.423 -2.625 0 C-N-CA 121.139 1.226 . . . . 73.23 112.516 -177.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.555 ' HA ' ' O ' ' A' ' 43' ' ' SER . 13.7 p -151.5 151.02 31.05 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 105.935 -1.876 . . . . 52.54 105.935 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.603 HD13 ' HD2' ' A' ' 25' ' ' ARG . 89.7 mt -50.45 -48.5 56.42 Favored 'General case' 0 CA--C 1.5 -0.964 0 O-C-N 123.647 0.592 . . . . 73.25 110.977 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.492 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -44.82 -46.9 10.92 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 113.594 -1.639 . . . . 40.42 112.144 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.577 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -64.81 -53.03 53.32 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-O 119.242 -0.408 . . . . 54.12 111.819 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.423 ' CG ' HD22 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -62.7 -34.95 78.2 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 108.326 -0.99 . . . . 74.51 108.326 -175.571 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -65.89 -51.65 56.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.311 -1.313 . . . . 51.4 110.605 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -72.37 -29.64 63.96 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 116.109 -0.496 . . . . 74.04 111.486 -178.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 81.6 mt -56.68 -28.09 60.09 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.213 0.449 . . . . 70.3 112.213 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 55.3 mtt -68.31 -54.99 13.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.648 -0.501 . . . . 71.32 109.648 174.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.94 -46.11 46.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.398 1.259 . . . . 73.41 114.398 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 m -73.35 2.55 7.34 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.767 0.794 . . . . 72.22 111.768 -175.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.628 ' NE ' ' HA ' ' A' ' 90' ' ' ARG . 1.4 mmp_? -120.92 -66.11 1.08 Allowed 'General case' 0 N--CA 1.418 -2.038 0 CA-C-N 115.614 -0.721 . . . . 71.3 112.069 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.431 ' HB2' ' CD ' ' A' ' 92' ' ' PRO 0.254 12.2 m 64.69 -84.3 0.0 OUTLIER Pre-proline 0 CA--C 1.596 2.721 0 CA-C-O 117.675 -1.155 . . . . 51.44 110.936 -167.603 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.605 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 73.0 Cg_endo -79.32 167.64 21.11 Favored 'Trans proline' 0 C--N 1.399 3.231 0 CA-C-N 123.211 2.183 . . . . 74.03 110.016 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.424 ' HA ' ' CD ' ' A' ' 68' ' ' ARG . 11.3 mm-40 . . . . . 0 C--O 1.263 1.792 0 C-N-CA 123.993 0.917 . . . . 61.41 112.672 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 p30 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 112.859 0.689 . . . . 71.03 112.859 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.47 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 20.1 m-80 -137.05 21.82 3.02 Favored 'General case' 0 C--O 1.206 -1.22 0 N-CA-C 115.901 1.815 . . . . 70.53 115.901 -174.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.543 ' H ' ' HD2' ' A' ' 16' ' ' ARG 0.425 0.1 OUTLIER -65.71 -74.7 0.1 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.532 -2.067 . . . . 74.4 113.999 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.503 ' HB2' HD21 ' A' ' 88' ' ' LEU . 64.4 m-70 -78.91 -21.97 46.56 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 121.134 -0.979 . . . . 74.34 110.007 173.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.558 ' HB2' HD23 ' A' ' 88' ' ' LEU . . . -69.54 -15.86 63.31 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 114.47 -1.241 . . . . 74.44 112.572 -177.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.94 60.0 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.119 0.485 . . . . 62.01 110.166 174.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.49 -34.73 78.94 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.697 -0.683 . . . . 73.13 109.431 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.535 ' CE1' HD22 ' A' ' 24' ' ' LEU . 91.1 t80 -63.3 -30.14 71.33 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.151 -0.477 . . . . 70.22 110.402 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.471 ' HA ' ' HB3' ' A' ' 25' ' ' ARG . 2.7 mp0 -67.27 -22.85 65.64 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 120.863 0.363 . . . . 73.34 111.7 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -78.14 -24.55 47.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.272 0.558 . . . . 73.3 110.428 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.637 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 2.0 tt -74.45 -48.99 24.14 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.453 -1.314 . . . . 64.4 107.453 171.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.504 ' HD2' HD13 ' A' ' 80' ' ' LEU . 27.7 ttt180 -57.45 -39.87 77.22 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.974 1.309 . . . . 73.0 114.043 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -50.43 -49.11 55.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.121 0.962 . . . . 74.43 108.812 176.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.85 -17.89 32.26 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 114.687 -1.142 . . . . 65.0 112.706 -177.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.443 HD12 ' CD2' ' A' ' 24' ' ' LEU . 1.2 tt -63.05 -42.79 99.8 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 108.752 -0.833 . . . . 73.35 108.752 174.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.1 mt -68.15 -27.61 37.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 114.78 -1.1 . . . . 70.41 110.023 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -74.92 -50.82 15.53 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.275 -0.875 . . . . 74.0 110.841 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.265 43.6 mt-10 -62.11 -29.12 70.11 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 116.229 1.937 . . . . 64.52 116.229 -174.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.498 HD12 HD11 ' A' ' 34' ' ' LEU . 46.0 mt -99.52 -4.06 32.07 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 118.435 -1.306 . . . . 73.31 112.255 170.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 t30 58.46 69.1 0.76 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.497 1.141 . . . . 61.33 108.388 -172.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.498 HD11 HD12 ' A' ' 32' ' ' LEU . 17.8 mt -109.13 163.09 13.65 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.133 -1.394 . . . . 65.44 109.666 -174.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 37.4 p -113.0 156.81 42.21 Favored Pre-proline 0 C--N 1.287 -2.112 0 N-CA-C 107.693 -1.225 . . . . 75.45 107.693 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -62.67 -17.29 58.03 Favored 'Trans proline' 0 N--CA 1.485 0.983 0 C-N-CA 122.397 2.064 . . . . 72.32 113.127 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -87.0 -29.99 21.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.232 0.539 . . . . 75.3 109.568 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -79.54 -48.11 14.39 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 108.722 -0.844 . . . . 72.45 108.722 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.02 76.83 1.95 Allowed 'General case' 0 N--CA 1.407 -2.581 0 N-CA-C 108.797 -0.816 . . . . 55.55 108.797 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -74.02 151.78 40.16 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 105.597 -2.001 . . . . 74.33 105.597 170.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.564 ' HA ' HD12 ' A' ' 80' ' ' LEU 0.354 5.1 pt-20 -68.37 -14.29 62.89 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 115.972 1.841 . . . . 74.15 115.972 -173.836 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -112.12 23.57 13.57 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.326 1.06 . . . . 63.32 108.423 174.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 29.9 t -91.9 151.44 20.53 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.056 -1.091 . . . . 62.23 108.056 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.501 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 19.2 t-20 -78.37 111.76 14.69 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.213 0.53 . . . . 75.31 111.398 -174.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.627 ' HB3' HD12 ' A' ' 50' ' ' LEU . 20.8 mt -66.24 -26.39 67.34 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 114.346 1.239 . . . . 65.41 114.346 -178.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.7 mm -72.42 -40.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.16 -0.616 . . . . 72.03 109.364 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -74.96 -16.43 60.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 72.55 110.311 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.61 -20.68 59.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.861 -0.792 . . . . 61.04 108.861 174.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.17 22.61 6.44 Favored Glycine 0 N--CA 1.43 -1.707 0 N-CA-C 115.251 0.861 . . . . 70.14 115.251 174.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.627 HD12 ' HB3' ' A' ' 45' ' ' LEU . 57.8 mt -69.67 110.31 4.8 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 118.213 1.006 . . . . 70.41 111.094 176.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 55' ' ' LEU . 3.4 p30 -75.07 169.24 18.4 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 107.896 -1.15 . . . . 73.45 107.896 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -73.36 -14.41 61.28 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 114.854 1.427 . . . . 74.13 114.854 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 50.7 mm -80.34 -46.36 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.193 0 N-CA-C 106.792 -1.558 . . . . 72.3 106.792 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.533 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 61.8 mtm180 -66.24 -20.75 66.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 121.307 0.575 . . . . 62.35 111.959 175.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.611 ' HG ' HD11 ' A' ' 71' ' ' LEU . 9.7 tp -78.58 -42.2 29.78 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.544 -0.91 . . . . 75.14 108.544 175.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.5 ttm -80.16 -18.77 48.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.878 -0.601 . . . . 71.24 110.094 -175.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' A' ' 54' ' ' ARG . 7.5 mmm180 -47.26 -43.24 21.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.136 1.375 . . . . 74.32 109.712 172.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.637 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 32.7 m95 -83.82 -26.05 29.85 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 113.878 -1.51 . . . . 70.2 113.856 -176.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.6 -42.25 74.58 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.919 0.39 . . . . 53.21 111.207 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -81.14 -26.53 36.02 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.15 0.5 . . . . 72.5 109.798 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.542 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 39.9 t90 -66.79 -42.57 85.77 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.74 -0.663 . . . . 65.44 109.679 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.501 ' CE2' HD21 ' A' ' 69' ' ' LEU . 64.7 m-85 -57.58 -48.78 78.44 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.352 1.073 . . . . 71.3 110.533 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -69.97 -12.83 61.9 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 114.336 -1.302 . . . . 72.02 113.842 -172.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -58.78 -30.02 67.24 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 120.834 0.349 . . . . 63.34 110.649 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.36 8.18 35.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 109.433 -0.58 . . . . 70.42 109.433 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.65 30.87 51.88 Favored Glycine 0 N--CA 1.433 -1.543 0 C-N-CA 120.664 -0.779 . . . . 25.03 111.522 -175.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . 0.272 28.1 m-85 -74.65 165.2 25.6 Favored 'General case' 0 CA--C 1.487 -1.469 0 C-N-CA 119.383 -0.927 . . . . 74.31 112.34 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -124.12 94.97 4.38 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 118.994 -1.083 . . . . 65.43 112.976 -160.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.501 HD21 ' CE2' ' A' ' 62' ' ' PHE . 3.4 pp -167.88 163.42 13.91 Favored 'General case' 0 C--O 1.256 1.413 0 N-CA-C 112.741 0.645 . . . . 72.23 112.741 171.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 77.7 p -112.77 154.5 26.11 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 106.208 -1.775 . . . . 63.3 106.208 171.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.691 HD12 HD12 ' A' ' 74' ' ' LEU . 19.2 tp -72.5 -23.98 61.1 Favored 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 120.678 -0.409 . . . . 71.51 111.058 -176.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -65.53 -19.86 66.1 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-O 120.833 0.349 . . . . 74.52 110.557 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -78.08 -31.42 50.13 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.047 0.927 . . . . 65.11 108.849 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.691 HD12 HD12 ' A' ' 71' ' ' LEU . 65.9 mt -77.6 -17.02 58.23 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.971 -1.468 . . . . 75.33 111.757 -176.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -81.18 -37.22 29.08 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.127 -0.694 . . . . 73.33 109.127 172.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.65 -46.69 62.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.307 -0.86 . . . . 62.03 110.656 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.11 83.08 56.23 Favored Pre-proline 0 N--CA 1.434 -1.26 0 N-CA-C 109.154 -0.684 . . . . 51.25 109.154 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.515 ' HA ' ' HE1' ' A' ' 83' ' ' TRP . 15.3 Cg_endo -95.27 86.7 0.11 Allowed 'Trans proline' 0 N--CA 1.417 -2.979 0 C-N-CA 121.337 1.358 . . . . 50.43 112.656 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 50.0 p -146.69 149.25 33.08 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 104.967 -2.234 . . . . 72.32 104.967 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 41' ' ' GLU . 81.7 mt -53.76 -43.54 69.27 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 118.43 0.559 . . . . 73.43 111.808 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -57.39 -43.23 83.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.18 -0.918 . . . . 44.43 111.546 -179.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.539 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.63 -48.05 78.85 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.79 -0.186 . . . . 73.22 111.438 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.515 ' HE1' ' HA ' ' A' ' 78' ' ' PRO . 5.8 m0 -62.05 -38.0 87.11 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.017 -0.735 . . . . 75.22 109.017 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.83 -54.8 37.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.85 -1.068 . . . . 61.14 110.093 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.404 ' HG2' ' CD ' ' A' ' 93' ' ' GLU . 90.5 mt-30 -69.45 -29.23 66.88 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 115.563 -0.744 . . . . 63.33 112.802 -177.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 67.8 mt -59.08 -18.81 38.57 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.02 0.827 . . . . 74.23 112.933 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.8 mtt -73.97 -57.46 3.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.448 0.642 . . . . 73.13 109.277 172.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.649 ' HB3' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm? -88.87 -31.4 18.28 Favored 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 116.619 2.081 . . . . 73.43 116.619 -170.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.0 p -64.37 -5.32 4.99 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 119.5 1.046 . . . . 71.43 113.658 -174.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 mtt-85 -95.6 5.78 50.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.052 -1.092 . . . . 73.11 108.052 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.8 m -150.29 -161.37 0.05 OUTLIER Pre-proline 0 CA--C 1.569 1.685 0 N-CA-C 104.138 -2.542 . . . . 65.34 104.138 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -62.37 118.85 5.75 Favored 'Trans proline' 0 C--N 1.366 1.468 0 CA-C-N 122.771 2.026 . . . . 72.12 110.207 170.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.649 ' HA ' ' HB3' ' A' ' 88' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.428 0 O-C-N 123.875 0.735 . . . . 70.13 109.241 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.532 ' N ' HD22 ' A' ' 84' ' ' ASN . 7.3 p-10 . . . . . 0 C--O 1.213 -0.827 0 N-CA-C 107.47 -1.307 . . . . 71.05 107.47 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -153.58 126.5 8.34 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.758 -0.777 . . . . 71.04 112.947 -173.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.293 0.0 OUTLIER -110.08 -75.82 0.62 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.481 0.548 . . . . 74.31 112.481 175.568 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -79.19 -30.84 43.62 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 104.688 -2.338 . . . . 54.41 104.688 169.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.27 -13.97 0.14 Allowed 'General case' 0 C--O 1.197 -1.674 0 CA-C-N 112.578 -2.101 . . . . 55.31 112.372 169.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.547 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -45.04 -22.02 0.08 Allowed 'General case' 0 C--O 1.199 -1.585 0 C-N-CA 123.906 0.882 . . . . 71.31 112.854 175.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.555 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 25.2 t70 -51.61 -42.39 61.93 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.121 -0.696 . . . . 64.03 109.121 170.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.695 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 75.1 t80 -59.12 -24.29 62.86 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 123.916 0.886 . . . . 75.14 110.71 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.547 ' HB2' ' O ' ' A' ' 19' ' ' ALA . 4.6 mm100 -57.91 -43.92 86.48 Favored 'General case' 0 C--O 1.189 -2.119 0 C-N-CA 120.354 -0.538 . . . . 73.3 112.206 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . 0.292 26.6 mp0 -72.46 -19.67 61.52 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.144 0.794 . . . . 73.51 113.144 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.515 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 5.0 tt -73.69 -32.61 64.04 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.659 -1.237 . . . . 71.11 107.659 170.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.2 ttp180 -83.26 -45.04 14.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.076 -0.966 . . . . 75.05 110.718 -173.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -60.88 -34.45 74.66 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 114.744 -1.116 . . . . 74.15 109.465 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.6 ttt85 -73.02 -42.14 63.51 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 119.393 -0.923 . . . . 73.34 110.357 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.417 HD21 ' HE1' ' A' ' 58' ' ' TRP . 15.6 mt -52.77 -36.73 58.45 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.489 0.922 . . . . 64.14 113.489 177.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.419 HG23 ' O ' ' A' ' 34' ' ' LEU . 61.0 mt -57.66 -45.3 86.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 O-C-N 123.728 0.643 . . . . 54.34 110.514 176.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -82.27 -34.6 28.67 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.909 -0.495 . . . . 53.12 111.338 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -49.51 -49.98 43.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.075 1.35 . . . . 73.35 111.715 -175.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD11 HD23 ' A' ' 50' ' ' LEU . 96.4 mt -110.91 11.41 22.3 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.252 -0.579 . . . . 73.43 112.034 176.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.73 37.77 22.01 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.844 0.831 . . . . 51.24 111.146 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.479 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 29.5 mt -80.31 129.48 34.53 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 108.171 -1.048 . . . . 74.45 108.171 -177.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -71.06 145.96 92.09 Favored Pre-proline 0 C--N 1.297 -1.691 0 N-CA-C 107.131 -1.433 . . . . 62.14 107.131 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -57.76 -16.25 24.47 Favored 'Trans proline' 0 N--CA 1.494 1.545 0 C-N-CA 122.508 2.138 . . . . 75.41 112.665 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -78.02 -23.14 48.33 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-O 121.272 0.558 . . . . 74.23 109.669 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -95.41 -43.64 7.91 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 108.791 -0.818 . . . . 74.44 108.791 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.443 HD23 HD13 ' A' ' 34' ' ' LEU . 2.4 tm? -85.75 76.74 9.89 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.463 1.125 . . . . 74.33 110.068 -175.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.532 ' O ' HD12 ' A' ' 80' ' ' LEU . 48.0 t-80 -112.67 164.75 12.97 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 105.395 -2.076 . . . . 73.31 105.395 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 23.7 mm-40 -46.89 -48.95 21.06 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 119.287 0.948 . . . . 64.43 111.321 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -80.1 24.25 0.43 Allowed 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.377 1.471 . . . . 71.15 113.864 -177.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.632 ' O ' ' HA ' ' A' ' 79' ' ' THR . 37.4 p -85.42 130.82 34.5 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 121.417 -0.802 . . . . 55.32 111.118 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.516 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 48.1 t-20 -78.96 100.67 7.38 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.97 -0.752 . . . . 70.12 108.97 177.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.503 ' HB3' HD12 ' A' ' 50' ' ' LEU . 82.3 mt -68.29 -17.3 64.24 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 114.42 1.267 . . . . 72.32 114.42 -175.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.9 mm -78.71 -34.16 17.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.83 -0.804 . . . . 72.13 108.83 177.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -77.89 -22.99 48.92 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.429 -0.805 . . . . 64.25 109.68 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.09 -27.53 62.72 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.254 -0.885 . . . . 41.05 109.684 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.33 32.22 2.83 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.51 -0.852 . . . . 51.13 115.218 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.503 HD23 HD11 ' A' ' 32' ' ' LEU . 76.5 mt -76.38 104.24 6.8 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 118.006 0.903 . . . . 53.33 110.374 174.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -64.34 158.84 22.46 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 107.966 -1.124 . . . . 73.51 107.966 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.8 m -65.62 -24.68 67.11 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 114.183 1.179 . . . . 65.3 114.183 -172.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.694 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 47.4 mm -76.43 -45.35 34.24 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.349 0 C-N-CA 118.108 -1.437 . . . . 62.04 107.594 178.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.473 ' HA ' ' NE ' ' A' ' 57' ' ' ARG . 10.7 ttm180 -55.85 -39.0 70.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.196 -0.911 . . . . 73.3 108.57 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.424 HD13 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -67.11 -54.45 21.26 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.142 -1.39 . . . . 73.23 111.193 177.722 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.439 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 22.2 ptm -72.89 -18.59 61.4 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.535 0.939 . . . . 73.12 113.535 -174.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.694 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 67.0 mtm180 -56.79 -37.89 71.78 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 108.126 -1.065 . . . . 73.34 108.126 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.515 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 21.6 m95 -65.59 -25.28 67.33 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.884 -1.507 . . . . 64.24 112.585 -176.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 64.3 tp -56.53 -40.54 75.26 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.214 0.53 . . . . 55.13 111.168 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -79.85 -30.67 40.41 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.796 -0.638 . . . . 70.11 109.5 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.562 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 14.6 t90 -64.13 -38.67 91.91 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.612 -0.722 . . . . 73.25 109.679 -177.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.458 ' CE1' HD21 ' A' ' 69' ' ' LEU . 52.0 m-85 -63.14 -54.14 42.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 121.678 0.751 . . . . 75.21 111.485 176.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.79 -14.79 63.24 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.802 -1.09 . . . . 75.32 111.528 -174.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.562 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 0.0 OUTLIER -53.72 -39.07 64.94 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 125.032 1.333 . . . . 74.22 111.383 173.933 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -114.58 27.97 9.07 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 122.376 1.084 . . . . 74.21 109.482 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 72.21 33.94 61.57 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.842 -1.072 . . . . 61.4 113.387 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -95.58 167.78 11.09 Favored 'General case' 0 CA--C 1.488 -1.405 0 C-N-CA 119.999 -0.68 . . . . 74.2 111.283 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.417 ' CG ' ' HB3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -140.38 107.67 5.52 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 115.048 1.499 . . . . 73.4 115.048 -165.629 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.458 HD21 ' CE1' ' A' ' 62' ' ' PHE . 4.1 pp -168.12 160.56 11.92 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.966 -1.015 . . . . 72.21 108.548 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.604 ' HB ' ' OE1' ' A' ' 73' ' ' GLU . 10.4 m -115.64 170.62 8.3 Favored 'General case' 0 N--CA 1.402 -2.862 0 N-CA-C 105.706 -1.961 . . . . 75.44 105.706 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 74' ' ' LEU . 4.7 tp -79.17 -23.41 43.94 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.563 -0.711 . . . . 71.34 112.461 -173.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -62.85 -27.33 69.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.886 0.374 . . . . 70.34 110.324 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' OE1' ' HB ' ' A' ' 70' ' ' THR . 2.3 mp0 -77.65 -36.29 51.65 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.044 -0.98 . . . . 72.11 109.464 -178.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 71' ' ' LEU . 17.0 mt -68.48 -28.88 67.42 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.196 -1.365 . . . . 70.35 109.134 177.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.424 ' CE1' HD13 ' A' ' 55' ' ' LEU . 7.6 m-85 -87.06 4.92 40.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.203 -0.908 . . . . 70.21 111.471 173.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -100.15 -47.81 4.84 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.221 -1.029 . . . . 51.03 108.221 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.94 90.04 51.66 Favored Pre-proline 0 N--CA 1.433 -1.315 0 N-CA-C 107.83 -1.174 . . . . 53.42 107.83 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.516 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 50.2 Cg_endo -81.95 87.17 1.45 Allowed 'Trans proline' 0 N--CA 1.434 -2.027 0 C-N-CA 121.269 1.313 . . . . 71.54 112.947 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.632 ' HA ' ' O ' ' A' ' 43' ' ' SER . 2.6 p -155.31 148.56 24.84 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 107.199 -1.408 . . . . 73.24 107.199 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' ' 40' ' ' HIS . 69.4 mt -52.19 -47.51 65.51 Favored 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 123.625 0.578 . . . . 72.42 110.367 177.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.406 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -44.69 -43.87 8.69 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 113.397 -1.728 . . . . 63.14 112.185 -179.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.559 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.15 -51.23 67.25 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 121.046 -0.261 . . . . 61.52 111.173 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.498 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -64.23 -36.18 83.24 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 107.778 -1.193 . . . . 73.21 107.778 -175.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.532 HD22 ' N ' ' A' ' 14' ' ' ASP . 6.9 t30 -65.28 -52.91 51.19 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.816 -1.538 . . . . 73.41 111.675 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -66.19 -27.57 68.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.686 0.279 . . . . 72.54 110.971 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 98.5 mt -64.61 -19.78 65.88 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.104 -0.498 . . . . 75.01 111.472 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.695 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 41.7 mtt -76.67 -45.73 28.51 Favored 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 116.636 -0.256 . . . . 74.32 110.406 173.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.3 -11.44 60.81 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.568 0.699 . . . . 72.41 110.66 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.2 m -82.97 11.29 6.35 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-N 116.089 -0.505 . . . . 72.11 111.791 176.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.669 ' HG3' ' O ' ' A' ' 87' ' ' MET . 0.1 OUTLIER -95.08 -27.25 15.69 Favored 'General case' 0 CA--C 1.512 -0.484 0 C-N-CA 119.668 -0.813 . . . . 64.4 112.554 177.51 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.8 p -169.91 161.62 6.85 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 107.532 -1.284 . . . . 53.55 107.532 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -59.1 118.66 5.58 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.337 1.358 . . . . 55.22 109.278 173.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 . . . . . 0 N--CA 1.412 -2.336 0 N-CA-C 103.416 -2.809 . . . . 71.34 103.416 -176.234 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 CA--C 1.509 -0.599 0 N-CA-C 107.647 -1.242 . . . . 61.24 107.647 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -149.58 25.95 0.85 Allowed 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 109.066 -0.716 . . . . 75.55 109.066 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.632 ' HD3' ' H ' ' A' ' 17' ' ' HIS 0.567 0.0 OUTLIER -100.23 -74.06 0.62 Allowed 'General case' 0 N--CA 1.427 -1.598 0 C-N-CA 119.068 -1.053 . . . . 72.34 113.307 172.991 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.632 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 6.9 m170 -79.8 -27.65 40.33 Favored 'General case' 0 C--O 1.213 -0.826 0 O-C-N 121.163 -0.961 . . . . 73.4 109.229 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.535 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -66.19 -15.05 62.83 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.042 -0.981 . . . . 60.0 110.917 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.67 -28.97 66.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.922 -0.486 . . . . 75.03 110.17 173.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.01 -33.82 74.26 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.767 0.794 . . . . 71.04 108.932 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.535 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 89.8 t80 -61.45 -22.86 65.43 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 114.987 -1.006 . . . . 63.41 110.05 177.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.05 -24.16 65.96 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 116.481 -0.327 . . . . 73.21 111.45 176.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -76.89 -33.22 57.83 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 120.816 0.341 . . . . 74.4 110.829 173.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.492 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 5.8 tt -62.14 -43.79 98.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.313 -1.366 . . . . 72.2 107.313 170.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.632 ' HD3' HD21 ' A' ' 80' ' ' LEU . 42.9 ttp180 -67.79 -36.43 80.45 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.414 -1.266 . . . . 72.33 113.408 -176.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -58.48 -38.76 78.28 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 108.537 -0.912 . . . . 74.22 108.537 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.431 ' HD2' ' N ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -79.52 -31.78 42.19 Favored 'General case' 0 C--O 1.195 -1.793 0 C-N-CA 120.336 -0.546 . . . . 73.33 111.267 176.645 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.527 HD13 HD12 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -59.92 -36.94 78.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.118 0.417 . . . . 71.53 110.617 179.444 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.575 HD13 HD13 ' A' ' 39' ' ' LEU . 15.5 mm -58.84 -46.86 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-O 121.934 0.873 . . . . 72.22 108.678 174.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -69.87 -42.81 72.98 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.677 -1.147 . . . . 75.03 111.818 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.459 ' CD ' ' HE ' ' A' ' 54' ' ' ARG . 5.7 mm-40 -47.44 -54.1 12.31 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.625 1.17 . . . . 75.1 113.937 -177.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.498 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 96.0 mt -103.47 9.8 37.51 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.1 -1.04 . . . . 74.14 112.276 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 62.46 28.75 16.95 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.705 0.764 . . . . 61.03 110.602 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.498 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 21.9 mt -80.64 129.9 34.79 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 107.329 -1.36 . . . . 63.03 107.329 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 35.6 p -78.95 157.38 76.31 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 108.593 -0.891 . . . . 61.03 108.593 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.11 -1.98 7.19 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.082 1.855 . . . . 61.14 113.346 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -98.02 -17.29 19.23 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 108.191 -1.04 . . . . 74.04 108.191 175.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -100.72 -39.45 7.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 114.67 -1.15 . . . . 74.54 108.331 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.575 HD13 HD13 ' A' ' 29' ' ' ILE . 1.4 tt -100.65 92.48 5.13 Favored 'General case' 0 N--CA 1.419 -2.01 0 CA-C-N 115.261 -0.881 . . . . 75.12 108.926 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -101.09 164.2 11.92 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 105.124 -2.176 . . . . 75.12 105.124 168.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.406 ' HB3' HD22 ' A' ' 80' ' ' LEU 0.34 14.3 pt-20 -77.6 -15.06 59.46 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 117.365 -1.734 . . . . 50.11 114.459 -169.897 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -81.68 -1.36 46.57 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.73 -0.668 . . . . 73.42 110.693 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 46.8 m -69.97 135.96 49.98 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-O 120.996 0.427 . . . . 71.2 111.416 178.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.564 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 44.4 t-20 -77.08 105.77 8.36 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.566 -1.272 . . . . 72.34 107.566 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 98.4 mt -66.24 -25.15 66.76 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.815 1.043 . . . . 73.24 113.815 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.6 mm -71.68 -34.38 52.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.698 -0.853 . . . . 75.33 108.698 178.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -80.09 -15.35 57.32 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.653 -0.703 . . . . 53.54 110.185 178.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.24 -11.23 55.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.792 -0.64 . . . . 73.24 109.355 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.47 30.04 10.35 Favored Glycine 0 N--CA 1.431 -1.648 0 CA-C-N 115.14 -0.936 . . . . 63.12 113.827 176.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.79 105.2 5.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 108.146 -1.057 . . . . 61.54 108.146 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.596 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.7 p30 -61.66 157.98 16.41 Favored 'General case' 0 C--O 1.252 1.2 0 CA-C-N 115.105 -0.952 . . . . 74.14 110.881 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.4 m -68.88 -16.91 63.89 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 113.05 0.759 . . . . 74.24 113.05 -177.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.52 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 43.2 mm -75.68 -39.94 39.76 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.679 0 C-N-CA 118.298 -1.361 . . . . 74.44 107.476 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.596 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 1.8 mpt_? -54.86 -49.27 71.54 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 109.36 -0.607 . . . . 73.24 109.36 173.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.527 ' HG ' HD11 ' A' ' 71' ' ' LEU . 5.6 tp -59.88 -40.15 87.74 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.136 -1.393 . . . . 75.02 110.443 -177.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.6 mtt -83.16 -24.76 32.36 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 112.422 0.527 . . . . 72.33 112.422 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.9 mtm180 -68.3 -41.95 80.16 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.763 -1.199 . . . . 75.55 107.763 173.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.492 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 6.7 m95 -60.94 -41.97 97.29 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 114.618 -1.174 . . . . 74.11 112.796 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 67.3 tp -52.83 -41.56 64.34 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.429 0.633 . . . . 71.51 110.554 177.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -81.11 -21.06 40.19 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.494 -0.776 . . . . 74.14 112.299 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -65.81 -52.12 53.24 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.03 -1.1 . . . . 73.53 108.03 174.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -55.38 -50.43 69.73 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 121.881 0.848 . . . . 75.3 108.801 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 25.2 ttt180 -60.88 -28.34 68.81 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 113.689 -1.596 . . . . 72.0 111.091 -175.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HA ' ' CE ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -83.15 -34.34 26.05 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 113.878 1.066 . . . . 72.13 113.878 176.929 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -78.63 -11.51 59.97 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 124.135 0.897 . . . . 72.13 111.72 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.69 6.62 49.56 Favored Glycine 0 CA--C 1.503 -0.684 0 N-CA-C 110.815 -0.914 . . . . 64.32 110.815 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -86.03 166.88 15.51 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 114.929 -0.635 . . . . 73.44 110.088 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.65 ' NH2' ' HA ' ' A' ' 92' ' ' PRO . 10.7 ptt180 -153.2 121.13 6.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 118.903 -1.119 . . . . 72.25 113.419 -166.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.1 pp -168.09 171.33 9.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.675 1.19 . . . . 65.43 108.631 174.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 81.1 p -109.5 142.92 39.87 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 109.212 -0.662 . . . . 51.44 109.212 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.527 HD11 ' HG ' ' A' ' 55' ' ' LEU . 23.8 tp -64.53 -24.31 67.56 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 112.174 0.435 . . . . 65.25 112.174 -176.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -60.02 -23.36 63.62 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.931 -0.577 . . . . 73.11 110.192 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -78.97 -39.48 34.23 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.262 -0.881 . . . . 65.43 110.13 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 71' ' ' LEU . 6.1 mp -65.55 -27.93 68.8 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.138 0.975 . . . . 71.51 111.052 177.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.446 ' CZ ' HD23 ' A' ' 55' ' ' LEU . 45.1 m-85 -80.44 -37.76 31.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.008 -0.542 . . . . 72.43 110.915 173.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -64.23 -47.07 81.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.065 0.46 . . . . 74.12 110.978 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -123.21 87.38 51.43 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 108.303 -0.999 . . . . 73.45 108.303 175.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.564 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 20.5 Cg_endo -83.36 86.77 1.36 Allowed 'Trans proline' 0 N--CA 1.417 -2.993 0 C-N-CA 120.915 1.077 . . . . 62.14 112.502 -175.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.1 p -151.98 145.74 25.06 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 106.041 -1.837 . . . . 53.33 106.041 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.632 HD21 ' HD3' ' A' ' 25' ' ' ARG . 9.0 tt -66.25 -38.08 87.01 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 120.774 0.321 . . . . 74.43 110.763 -175.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 84' ' ' ASN . . . -59.63 -28.07 66.9 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.458 0.703 . . . . 65.44 110.806 177.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.613 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.24 -46.75 69.62 Favored 'General case' 0 C--O 1.2 -1.541 0 CA-C-N 115.753 -0.658 . . . . 63.52 110.683 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -34.76 78.72 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.221 -1.029 . . . . 75.31 108.221 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.413 ' HB3' ' O ' ' A' ' 81' ' ' ALA . 48.5 t-20 -54.3 -55.44 28.33 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 74.52 108.566 176.31 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -71.5 -33.01 68.86 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-N 115.464 -0.789 . . . . 75.01 111.987 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 82.4 mt -56.85 -36.82 70.47 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 111.834 0.309 . . . . 60.22 111.834 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.501 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 36.9 mtt -53.61 -61.01 2.58 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.68 0.612 . . . . 64.11 109.354 173.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.42 -17.13 63.62 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.442 1.275 . . . . 75.42 114.442 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.8 m -78.34 -15.96 58.19 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.514 0.673 . . . . 71.35 110.093 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 13.1 mmt180 -109.49 11.85 24.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.398 -1.334 . . . . 63.32 107.398 175.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.4 m 31.91 85.6 0.15 Allowed Pre-proline 0 C--O 1.234 0.241 0 C-N-CA 128.555 2.742 . . . . 74.54 115.514 175.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.65 ' HA ' ' NH2' ' A' ' 68' ' ' ARG . 11.8 Cg_endo -94.66 115.09 0.2 Allowed 'Trans proline' 0 N--CA 1.421 -2.793 0 C-N-CA 120.891 1.061 . . . . 62.42 110.486 174.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 127.978 2.511 . . . . 71.42 114.369 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.4 t0 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 106.411 -1.7 . . . . 62.24 106.411 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 19' ' ' ALA . 17.1 m120 -139.21 108.52 6.11 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 117.912 0.324 . . . . 51.14 111.697 -171.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.634 ' HB2' ' OXT' ' A' ' 93' ' ' GLU . 0.7 OUTLIER -110.8 -76.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.298 -1.001 . . . . 73.02 108.298 174.561 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -77.8 -28.5 50.44 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 122.887 1.327 . . . . 64.41 107.882 169.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' A' ' 15' ' ' ASN . . . -58.89 -12.7 4.77 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 112.868 -1.969 . . . . 64.0 112.382 173.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 15' ' ' ASN . . . -42.24 -27.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 114.084 1.142 . . . . 72.3 114.084 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -57.58 -42.33 82.9 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 109.313 -0.625 . . . . 71.0 109.313 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 71.3 t80 -59.04 -22.14 60.23 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.11 1.364 . . . . 72.01 111.315 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -59.15 -37.32 77.03 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.835 -0.432 . . . . 71.13 109.835 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.638 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 15.6 tt0 -71.3 -19.47 62.32 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.139 0.971 . . . . 71.5 110.774 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.547 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 5.4 tt -68.3 -21.71 64.76 Favored 'General case' 0 C--N 1.308 -1.229 0 O-C-N 121.478 -0.764 . . . . 75.12 109.801 173.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.497 HH21 ' HB3' ' A' ' 41' ' ' GLU . 2.5 mpt_? -80.86 -41.89 22.41 Favored 'General case' 0 CA--C 1.476 -1.885 0 O-C-N 121.688 -0.633 . . . . 73.44 109.802 -178.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.666 ' HG3' ' HG3' ' A' ' 27' ' ' ARG . 9.3 pt-20 -55.37 -40.77 71.73 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 124.549 1.156 . . . . 73.32 109.723 -174.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.666 ' HG3' ' HG3' ' A' ' 26' ' ' GLU . 91.0 mtt180 -87.69 -30.96 19.99 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.726 -0.67 . . . . 74.31 112.326 -178.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -66.41 -36.19 82.2 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.881 0.372 . . . . 65.22 110.402 178.497 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.482 HG23 ' O ' ' A' ' 34' ' ' LEU . 66.2 mt -60.17 -41.15 85.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.496 . . . . 72.21 109.828 176.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -72.89 -39.08 66.69 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.174 -0.466 . . . . 72.01 110.42 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -47.1 -54.11 11.21 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.298 1.439 . . . . 74.22 112.108 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.519 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 94.9 mt -106.95 10.48 30.46 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 119.197 -1.001 . . . . 75.2 112.836 177.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 58.37 42.64 21.11 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.28 1.038 . . . . 74.11 109.731 -177.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 37.1 mt -79.99 133.96 36.2 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.337 -1.301 . . . . 72.04 109.783 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -75.31 147.44 82.66 Favored Pre-proline 0 C--N 1.29 -1.989 0 N-CA-C 105.761 -1.94 . . . . 74.13 105.761 174.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -55.75 -28.99 69.52 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.792 1.662 . . . . 62.52 112.381 178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -76.76 -7.33 55.17 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 120.965 0.412 . . . . 71.13 110.864 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -111.76 -2.43 15.29 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.927 -1.138 . . . . 53.23 107.927 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.433 ' CD1' HD11 ' A' ' 80' ' ' LEU . 2.6 tm? -142.04 80.03 1.7 Allowed 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 122.377 1.084 . . . . 61.5 110.92 -176.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -117.33 166.35 12.39 Favored 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 105.42 -2.067 . . . . 74.41 105.42 172.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.598 ' HA ' ' HB2' ' A' ' 80' ' ' LEU 0.46 8.9 pt-20 -63.87 -11.72 30.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 118.437 2.755 . . . . 61.13 118.437 -171.788 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.57 -8.37 35.22 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 118.597 0.635 . . . . 73.03 109.461 -179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -67.24 126.97 30.91 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.336 -0.847 . . . . 65.2 111.28 -177.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.543 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 41.5 t-20 -75.3 117.89 17.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.342 -0.845 . . . . 70.4 110.222 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.514 ' HB3' HD12 ' A' ' 50' ' ' LEU . 86.9 mt -76.49 -25.05 53.85 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.473 1.286 . . . . 65.15 114.473 -174.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.438 HG12 ' CB ' ' A' ' 78' ' ' PRO . 37.0 mm -76.92 -33.1 20.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 109.07 -0.715 . . . . 71.32 109.07 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -78.65 -13.54 59.77 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.559 -0.746 . . . . 71.32 109.78 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.45 -29.33 28.13 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.684 -0.858 . . . . 60.23 108.684 175.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.94 30.48 2.31 Favored Glycine 0 N--CA 1.439 -1.145 0 N-CA-C 115.212 0.845 . . . . 31.01 115.212 174.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' A' ' 45' ' ' LEU . 52.1 mt -76.74 109.29 10.4 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 118.199 0.999 . . . . 74.43 110.609 175.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.401 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 2.9 p30 -70.7 167.55 18.45 Favored 'General case' 0 C--O 1.252 1.216 0 N-CA-C 109.223 -0.658 . . . . 71.24 109.223 174.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.473 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 15.6 m -68.47 -16.97 64.08 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.602 1.334 . . . . 74.31 114.602 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.615 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 51.4 mm -74.16 -43.79 50.55 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.539 0 N-CA-C 106.955 -1.498 . . . . 61.24 106.955 177.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -60.95 -40.11 92.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.788 -0.819 . . . . 61.44 108.788 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.579 ' HB3' HD11 ' A' ' 71' ' ' LEU . 43.3 mt -55.76 -50.55 70.1 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.948 -1.024 . . . . 55.02 111.124 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.5 ptp -79.53 -18.15 52.48 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.942 0.719 . . . . 64.12 112.942 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 94.4 mtt180 -59.61 -47.58 85.05 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 106.94 -1.504 . . . . 71.04 106.94 172.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -63.18 -36.71 84.52 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 113.929 -1.487 . . . . 74.04 113.102 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 60.2 tp -54.97 -36.31 65.22 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.433 0.635 . . . . 72.02 110.846 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -77.28 -30.17 54.17 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.745 -0.661 . . . . 73.03 110.82 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.482 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 69.2 t90 -71.81 -35.51 69.96 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.91 -0.586 . . . . 71.54 109.668 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -66.64 -50.69 62.13 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 122.034 0.921 . . . . 73.03 109.455 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -65.57 -13.64 59.43 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 114.408 -1.269 . . . . 75.11 111.372 -175.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 2.8 ttpm? -48.82 -44.69 39.57 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.948 1.699 . . . . 55.02 111.341 174.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -105.64 14.07 28.95 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 108.616 -0.883 . . . . 75.32 108.616 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 74.99 26.9 65.56 Favored Glycine 0 N--CA 1.42 -2.405 0 CA-C-N 114.95 -1.023 . . . . 63.24 111.845 -176.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -66.36 162.8 19.54 Favored 'General case' 0 CA--C 1.484 -1.57 0 CA-C-N 117.498 0.649 . . . . 73.12 110.537 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 63.9 mtm-85 -134.65 99.75 4.43 Favored 'General case' 0 C--N 1.283 -2.309 0 C-N-CA 118.715 -1.194 . . . . 64.1 113.446 -162.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 pp -161.41 157.29 24.96 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.571 -0.74 . . . . 72.2 109.981 175.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.2 p -104.88 142.89 33.94 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 108.326 -0.99 . . . . 74.41 108.326 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.588 HD12 HD12 ' A' ' 74' ' ' LEU . 23.5 tp -61.85 -24.98 67.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.477 0.656 . . . . 74.15 110.207 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.73 -28.17 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 125.305 1.442 . . . . 73.24 110.265 175.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -86.52 -28.97 23.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.569 -0.741 . . . . 75.21 110.365 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.588 HD12 HD12 ' A' ' 71' ' ' LEU . 29.9 mt -75.48 -21.7 57.85 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.111 -0.95 . . . . 70.41 110.801 -177.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -78.87 -36.41 42.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.524 . . . . 71.05 109.788 173.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.27 75.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.583 -0.735 . . . . 65.51 110.847 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.73 87.13 56.66 Favored Pre-proline 0 N--CA 1.43 -1.459 0 N-CA-C 109.028 -0.73 . . . . 60.34 109.028 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.543 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 34.6 Cg_endo -90.38 86.55 0.36 Allowed 'Trans proline' 0 N--CA 1.418 -2.922 0 C-N-CA 121.058 1.172 . . . . 74.3 112.951 -177.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.1 p -150.17 147.05 27.25 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 105.118 -2.178 . . . . 75.3 105.118 175.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.598 ' HB2' ' HA ' ' A' ' 41' ' ' GLU . 88.2 mt -50.93 -47.61 60.93 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 118.432 0.56 . . . . 71.41 111.193 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.53 -44.45 36.29 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 114.551 -1.204 . . . . 61.24 112.287 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.418 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.98 -44.28 69.76 Favored 'General case' 0 C--O 1.21 -1.009 0 N-CA-C 111.921 0.341 . . . . 72.25 111.921 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.457 ' CG ' HD22 ' A' ' 74' ' ' LEU . 3.9 m0 -63.25 -36.44 83.65 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.109 -1.071 . . . . 74.12 108.109 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.431 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 8.4 t30 -65.57 -48.46 72.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.352 -1.295 . . . . 73.11 109.845 177.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -58.35 -42.89 87.91 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.007 -0.997 . . . . 63.02 110.286 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 91.0 mt -65.99 -29.17 69.51 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.69 0.996 . . . . 64.32 113.69 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.602 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 7.6 ptp -82.25 -37.2 26.29 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 118.833 -1.147 . . . . 74.44 110.371 174.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.439 HD21 ' OXT' ' A' ' 93' ' ' GLU . 3.0 tm? -69.55 -39.64 77.3 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.627 -0.715 . . . . 71.41 110.861 -177.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.5 m -75.18 19.19 0.17 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.566 0.58 . . . . 71.35 112.566 -177.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 68' ' ' ARG . 24.3 mmt180 -128.78 -1.45 5.37 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 107.425 -1.324 . . . . 75.4 107.425 175.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.427 ' HB3' ' HD2' ' A' ' 92' ' ' PRO . 15.7 m -136.49 174.63 4.26 Favored Pre-proline 0 N--CA 1.437 -1.101 0 N-CA-C 108.385 -0.969 . . . . 74.24 108.385 -170.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 91' ' ' SER . 30.4 Cg_endo -67.59 159.32 53.08 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 120.962 1.108 . . . . 73.43 109.962 170.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.634 ' OXT' ' HB2' ' A' ' 16' ' ' ARG . 43.4 mt-10 . . . . . 0 C--N 1.314 -0.947 0 O-C-N 123.809 0.693 . . . . 74.24 112.294 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.605 ' HB3' ' OXT' ' A' ' 93' ' ' GLU . 2.2 m-20 . . . . . 0 CA--C 1.488 -1.437 0 CA-C-O 118.275 -0.869 . . . . 41.05 109.642 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.438 ' H ' ' C ' ' A' ' 93' ' ' GLU . 18.4 t-20 72.83 80.46 0.14 Allowed 'General case' 0 N--CA 1.476 0.872 0 O-C-N 125.191 1.557 . . . . 54.35 107.516 -172.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.583 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 1.5 mpt_? -86.18 -71.07 0.56 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 114.522 1.305 . . . . 71.32 114.522 -169.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.597 ' H ' HD11 ' A' ' 88' ' ' LEU . 47.2 m170 -54.1 -37.01 63.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.009 0.923 . . . . 74.02 112.701 -173.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.467 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -65.27 -14.99 62.01 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 113.854 1.057 . . . . 63.05 113.854 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.54 -32.68 63.15 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.847 -0.533 . . . . 63.25 110.887 174.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.436 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 28.3 t70 -70.01 -36.87 75.44 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 108.627 -0.879 . . . . 71.35 108.627 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.543 ' CE1' HD22 ' A' ' 24' ' ' LEU . 75.4 t80 -59.7 -22.53 62.11 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.778 -1.101 . . . . 72.33 111.139 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -68.16 -22.48 64.84 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.425 -0.51 . . . . 75.43 110.404 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 23.6 tp60 -72.95 -34.79 66.75 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.587 -0.894 . . . . 73.23 108.587 172.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.543 HD22 ' CE1' ' A' ' 21' ' ' TYR . 5.5 tt -70.31 -33.61 71.74 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.599 -0.889 . . . . 72.33 108.599 175.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HD2' HD13 ' A' ' 80' ' ' LEU . 3.2 tpp180 -63.25 -49.02 75.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.011 -0.737 . . . . 63.14 109.011 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.508 ' OE1' ' HD2' ' A' ' 27' ' ' ARG . 4.2 tm-20 -53.34 -49.76 66.42 Favored 'General case' 0 CA--C 1.509 -0.599 0 O-C-N 124.438 1.086 . . . . 74.04 108.302 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.508 ' HD2' ' OE1' ' A' ' 26' ' ' GLU . 12.1 mmm180 -56.63 -50.99 70.41 Favored 'General case' 0 C--O 1.189 -2.13 0 CA-C-N 115.323 -0.853 . . . . 72.32 111.507 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.453 HD23 ' HA ' ' A' ' 28' ' ' LEU . 28.8 mt -50.68 -41.31 55.57 Favored 'General case' 0 C--O 1.245 0.826 0 N-CA-C 114.649 1.351 . . . . 73.03 114.649 -176.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.425 HG23 ' O ' ' A' ' 34' ' ' LEU . 60.1 mt -62.96 -48.97 85.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 O-C-N 123.605 0.566 . . . . 62.24 109.681 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -72.15 -44.54 62.94 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 112.842 0.682 . . . . 74.1 112.842 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -56.0 -53.12 60.81 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 123.939 0.896 . . . . 74.42 113.417 -176.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.466 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 96.5 mt -100.58 7.36 44.08 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 118.757 -1.177 . . . . 61.14 112.641 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 62.15 38.33 13.78 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.842 0.83 . . . . 74.44 109.936 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.466 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 54.6 mt -80.49 130.62 35.26 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 114.923 -1.035 . . . . 75.54 108.252 -177.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.0 p -76.24 162.93 69.43 Favored Pre-proline 0 C--N 1.299 -1.597 0 N-CA-C 108.693 -0.854 . . . . 75.13 108.693 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -63.03 -14.68 43.05 Favored 'Trans proline' 0 N--CA 1.487 1.141 0 C-N-CA 121.781 1.654 . . . . 72.32 113.151 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -98.22 0.49 45.89 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 121.644 0.735 . . . . 73.23 109.369 177.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -114.87 -8.69 12.54 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.538 -1.282 . . . . 71.33 107.538 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.474 HD13 HD11 ' A' ' 80' ' ' LEU . 2.2 tm? -143.12 76.18 1.51 Allowed 'General case' 0 N--CA 1.416 -2.128 0 CA-C-O 122.251 1.024 . . . . 74.15 109.62 -178.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -117.44 165.67 13.24 Favored 'General case' 0 C--N 1.283 -2.289 0 N-CA-C 106.517 -1.66 . . . . 64.02 106.517 173.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.36 -33.23 5.62 Favored 'General case' 0 CA--C 1.569 1.71 0 C-N-CA 125.039 1.335 . . . . 62.12 113.703 -173.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -1.88 37.8 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.91 -0.494 . . . . 75.3 111.401 -174.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -69.6 129.57 40.02 Favored 'General case' 0 C--O 1.251 1.152 0 CA-C-O 121.37 0.605 . . . . 63.35 112.112 -174.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.528 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 46.3 t-20 -74.24 112.33 10.29 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.359 -0.837 . . . . 64.33 109.689 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.1 mt -70.76 -26.18 63.24 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 114.469 1.285 . . . . 75.03 114.469 -176.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.4 HG12 ' HB3' ' A' ' 78' ' ' PRO . 46.7 mm -72.77 -33.75 44.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.657 -0.868 . . . . 61.02 108.657 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -81.02 -12.13 59.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.465 -0.789 . . . . 73.22 109.971 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.86 -7.94 59.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.032 -0.729 . . . . 72.35 109.032 176.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.9 37.06 6.15 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.939 -1.028 . . . . 60.2 113.245 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.78 103.64 16.16 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 108.219 -1.03 . . . . 65.42 108.219 178.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.479 ' OD1' ' HB2' ' A' ' 54' ' ' ARG . 3.9 p-10 -66.07 166.19 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.255 -0.884 . . . . 70.04 109.546 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -77.19 -14.74 59.73 Favored 'General case' 0 N--CA 1.424 -1.731 0 N-CA-C 114.401 1.26 . . . . 54.23 114.401 -174.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.627 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 46.2 mm -83.93 -36.96 12.69 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.35 0 N-CA-C 106.819 -1.549 . . . . 72.35 106.819 175.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HB2' ' OD1' ' A' ' 51' ' ' ASP . 1.7 tpt85 -55.92 -45.73 78.66 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 106.936 -1.505 . . . . 75.5 106.936 174.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.17 -46.71 89.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.51 -1.677 . . . . 74.45 110.057 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 47.9 ttm -74.86 -25.33 58.9 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.217 -0.447 . . . . 70.22 112.016 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 37.0 mmt180 -64.29 -36.41 84.03 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.242 -0.651 . . . . 75.22 109.242 176.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -65.19 -29.61 70.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.998 -1.001 . . . . 61.22 112.148 179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.91 -27.1 66.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.403 0.62 . . . . 71.44 110.594 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -81.15 -40.73 23.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.032 -0.729 . . . . 74.11 109.032 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.528 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 24.4 t90 -63.29 -41.15 98.96 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 115.305 -0.862 . . . . 75.05 110.404 -177.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.455 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 61.5 m-85 -61.21 -51.2 70.0 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.813 0.816 . . . . 75.23 111.106 177.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -68.55 -13.23 62.19 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.256 -0.883 . . . . 72.53 113.221 -173.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 21.4 ttpp -44.9 -48.22 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.68 1.592 . . . . 74.5 112.5 173.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.417 ' HB2' ' CE2' ' A' ' 67' ' ' TYR . 6.5 m-20 -96.77 12.47 31.92 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.039 0.447 . . . . 72.11 110.397 -178.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 82.57 17.19 69.02 Favored Glycine 0 N--CA 1.421 -2.361 0 C-N-CA 120.24 -0.981 . . . . 22.01 111.486 -176.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.549 ' CE1' ' HB3' ' A' ' 17' ' ' HIS . 27.7 m-85 -66.62 165.16 15.29 Favored 'General case' 0 CA--C 1.485 -1.523 0 CA-C-O 121.444 0.64 . . . . 70.42 111.314 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -136.54 103.45 5.25 Favored 'General case' 0 C--N 1.282 -2.369 0 C-N-CA 119.613 -0.835 . . . . 71.24 111.363 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.422 HD11 ' CD2' ' A' ' 62' ' ' PHE . 3.9 pp -159.64 152.34 21.49 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.537 0.523 . . . . 64.13 110.918 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -96.98 146.62 24.8 Favored 'General case' 0 N--CA 1.406 -2.651 0 N-CA-C 105.882 -1.896 . . . . 71.21 105.882 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.509 HD12 HD12 ' A' ' 74' ' ' LEU . 17.0 tp -72.65 -25.31 61.23 Favored 'General case' 0 C--N 1.291 -1.97 0 C-N-CA 120.057 -0.657 . . . . 75.24 110.471 -175.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -62.89 -19.98 64.71 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.087 -0.506 . . . . 71.4 110.413 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.58 -31.58 57.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.618 0.723 . . . . 71.03 109.194 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.509 HD12 HD12 ' A' ' 71' ' ' LEU . 18.0 mt -75.05 -22.52 58.34 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.339 -0.846 . . . . 75.45 109.485 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -87.76 -2.02 58.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.613 -0.721 . . . . 73.22 110.128 174.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.29 -51.52 5.26 Favored 'General case' 0 CA--C 1.503 -0.838 0 N-CA-C 108.751 -0.833 . . . . 71.11 108.751 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.39 87.45 56.22 Favored Pre-proline 0 N--CA 1.43 -1.459 0 N-CA-C 107.78 -1.193 . . . . 53.22 107.78 174.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.528 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 1.7 Cg_endo -81.16 86.75 1.57 Allowed 'Trans proline' 0 N--CA 1.43 -2.211 0 C-N-CA 121.146 1.231 . . . . 73.42 112.371 -175.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.2 p -153.23 153.38 32.59 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 105.857 -1.905 . . . . 52.34 105.857 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.552 HD13 ' HD2' ' A' ' 25' ' ' ARG . 37.9 mt -50.47 -50.79 51.49 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.832 0.708 . . . . 74.13 111.822 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -44.65 -43.7 8.46 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 113.854 -1.521 . . . . 71.25 113.225 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -65.14 -48.7 72.63 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 120.985 -0.286 . . . . 74.12 111.283 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.439 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.9 OUTLIER -65.16 -35.43 81.06 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 108.124 -1.065 . . . . 74.44 108.124 -175.715 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -64.86 -53.73 42.02 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 114.655 -1.157 . . . . 75.41 109.436 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -70.27 -25.31 63.29 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.005 0.742 . . . . 55.24 113.005 -177.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 88.8 mt -62.21 -19.15 62.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.721 0.637 . . . . 72.25 112.721 179.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.426 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 59.0 mtt -74.97 -35.56 62.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.006 0.431 . . . . 64.11 110.007 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.597 HD11 ' H ' ' A' ' 17' ' ' HIS . 2.9 mm? -92.81 -14.05 28.32 Favored 'General case' 0 C--O 1.195 -1.779 0 N-CA-C 113.576 0.954 . . . . 74.01 113.576 178.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -74.68 22.35 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 CA-C-O 121.431 0.634 . . . . 72.3 111.811 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.438 ' H ' ' C ' ' A' ' 88' ' ' LEU . 22.7 mmt180 -132.02 2.01 3.95 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.486 -1.301 . . . . 64.11 107.486 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.407 ' HB3' ' CD ' ' A' ' 92' ' ' PRO . 49.0 m -159.8 -169.22 0.22 Allowed Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 107.234 -1.395 . . . . 64.5 107.234 -172.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.407 ' CD ' ' HB3' ' A' ' 91' ' ' SER . 13.7 Cg_exo -75.08 161.47 38.47 Favored 'Trans proline' 0 C--N 1.365 1.427 0 CA-C-N 121.125 1.437 . . . . 72.15 110.617 169.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.605 ' OXT' ' HB3' ' A' ' 14' ' ' ASP . 10.9 tp10 . . . . . 0 N--CA 1.473 0.691 0 C-N-CA 125.041 1.336 . . . . 73.11 110.473 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 . . . . . 0 N--CA 1.477 0.9 0 N-CA-C 108.817 -0.809 . . . . 63.22 108.817 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.644 ' HB2' ' HB3' ' A' ' 18' ' ' ALA . 6.5 p30 -94.94 164.0 13.09 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 123.578 0.751 . . . . 73.54 109.02 175.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.622 ' NE ' ' HB2' ' A' ' 93' ' ' GLU . 83.6 mtm180 -110.08 -79.71 0.58 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 119.354 -0.938 . . . . 62.04 112.954 -173.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.2 t-80 -81.62 -33.87 31.22 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 103.898 -2.631 . . . . 73.03 103.898 168.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.644 ' HB3' ' HB2' ' A' ' 15' ' ' ASN . . . -45.31 -14.45 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 110.878 -2.874 . . . . 72.15 114.134 174.004 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.54 -22.07 0.14 Allowed 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.968 0.907 . . . . 70.01 112.466 174.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.522 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 23.8 t70 -54.31 -42.07 69.69 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.32 -0.622 . . . . 73.22 109.32 170.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.529 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 69.1 t80 -60.27 -22.65 63.36 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 124.147 0.979 . . . . 73.32 110.466 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -60.44 -29.02 68.74 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.069 0.462 . . . . 74.42 110.203 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 27' ' ' ARG . 41.5 mm-40 -82.04 -24.94 35.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.696 0.628 . . . . 74.25 112.696 175.16 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 61' ' ' TRP . 4.7 tt -73.35 -34.6 65.72 Favored 'General case' 0 C--O 1.208 -1.085 0 N-CA-C 107.062 -1.459 . . . . 55.34 107.062 173.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.47 HH21 ' CD ' ' A' ' 41' ' ' GLU . 5.1 tpt180 -57.48 -58.01 10.15 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.105 1.362 . . . . 73.43 109.389 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -58.28 -45.34 88.07 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.119 -0.946 . . . . 72.11 109.676 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -63.09 -45.93 89.76 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.011 -0.995 . . . . 73.03 110.555 -177.158 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.72 -44.74 86.18 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.488 0.715 . . . . 55.42 110.016 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.564 HG12 HD13 ' A' ' 39' ' ' LEU . 54.0 mt -63.89 -44.93 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 115.17 -0.923 . . . . 74.13 111.124 178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -70.36 -36.01 73.9 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 113.602 0.964 . . . . 44.42 113.602 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.6 -42.25 99.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 116.241 1.941 . . . . 74.44 116.241 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.526 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 88.5 mt -95.51 17.69 14.19 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 118.366 -1.334 . . . . 74.43 111.348 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.7 t30 60.56 37.89 19.21 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 122.969 1.366 . . . . 70.45 109.091 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.526 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 24.2 mt -88.45 164.66 15.37 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 114.287 -1.324 . . . . 74.01 108.433 -178.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.406 ' H ' ' HB3' ' A' ' 38' ' ' GLN . 20.8 p -135.44 164.6 42.46 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 105.4 -2.074 . . . . 54.11 105.4 176.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.56 -16.09 45.73 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 121.919 1.746 . . . . 73.1 112.383 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -88.06 -28.83 21.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.274 -0.421 . . . . 64.13 110.271 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.406 ' HB3' ' H ' ' A' ' 35' ' ' THR . 33.8 tt0 -94.6 -19.31 20.58 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-O 121.406 0.622 . . . . 74.42 110.147 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.564 HD13 HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -128.21 93.96 3.79 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 107.354 -1.351 . . . . 54.42 107.354 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.433 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 17.6 t-80 -97.98 147.76 24.16 Favored 'General case' 0 C--N 1.286 -2.188 0 N-CA-C 104.05 -2.574 . . . . 72.11 104.05 167.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.47 ' CD ' HH21 ' A' ' 25' ' ' ARG 0.362 8.9 pt-20 -78.63 5.72 10.4 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 118.91 2.93 . . . . 73.1 118.91 -166.463 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.433 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -94.52 -13.62 25.91 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.672 -1.232 . . . . 62.41 107.672 174.84 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.1 m -77.64 146.34 36.17 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 114.503 -1.226 . . . . 72.43 111.614 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.603 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.7 t-20 -77.76 115.77 17.77 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.027 -0.988 . . . . 71.22 110.817 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.43 -25.16 67.89 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.935 1.087 . . . . 72.0 113.935 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.5 mm -68.53 -32.65 56.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.834 -0.802 . . . . 74.12 108.834 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -80.5 -10.89 59.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.136 -0.938 . . . . 70.4 110.221 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -89.0 -5.44 57.95 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.748 -0.834 . . . . 73.12 108.748 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.01 31.91 10.45 Favored Glycine 0 N--CA 1.431 -1.667 0 CA-C-N 114.953 -1.021 . . . . 51.03 113.695 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.5 tp -76.7 102.07 6.04 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.131 -1.063 . . . . 62.14 108.131 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.552 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 4.2 p30 -59.3 153.48 18.66 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.75 -1.113 . . . . 75.24 109.784 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' ' 56' ' ' MET . 32.3 m -71.8 -14.73 62.06 Favored 'General case' 0 N--CA 1.419 -1.978 0 N-CA-C 113.674 0.99 . . . . 73.21 113.674 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.673 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 46.4 mm -75.01 -43.81 44.92 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.27 0 C-N-CA 118.199 -1.401 . . . . 64.31 107.329 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.552 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 0.2 OUTLIER -50.62 -50.01 55.32 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 108.049 -1.093 . . . . 72.5 108.049 175.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.513 ' HG ' HD11 ' A' ' 71' ' ' LEU . 9.7 tp -56.78 -52.53 64.68 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 112.989 -1.914 . . . . 72.01 111.282 -178.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' A' ' 52' ' ' SER . 20.4 ptp -79.97 -18.9 49.17 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 113.951 1.093 . . . . 63.42 113.951 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.673 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 60.6 mtm180 -64.99 -42.6 94.37 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 106.327 -1.731 . . . . 71.22 106.327 172.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.519 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 6.1 m95 -56.93 -37.78 71.98 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 113.835 -1.53 . . . . 74.02 112.416 -178.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.7 -37.33 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.725 0.774 . . . . 71.1 109.862 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -81.03 -29.33 35.13 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.507 -0.769 . . . . 72.12 110.635 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.626 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 33.8 t90 -69.25 -36.98 77.71 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.886 -0.783 . . . . 74.24 108.886 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.478 ' HD1' ' HE2' ' A' ' 87' ' ' MET . 59.8 m-85 -62.42 -50.29 72.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.518 1.152 . . . . 63.54 109.4 173.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -65.82 -12.65 55.89 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.699 -1.591 . . . . 75.31 113.9 -171.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.626 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 29.4 mtmm -48.35 -50.82 29.03 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-O 121.556 0.693 . . . . 73.42 110.599 178.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -100.88 17.59 21.77 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 114.861 -1.063 . . . . 65.31 108.982 -173.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.44 33.68 52.28 Favored Glycine 0 N--CA 1.419 -2.473 0 CA-C-N 114.899 -1.046 . . . . 73.23 112.804 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -71.12 166.15 22.05 Favored 'General case' 0 CA--C 1.478 -1.807 0 C-N-CA 118.996 -1.082 . . . . 74.1 111.107 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -138.81 106.58 5.64 Favored 'General case' 0 C--N 1.277 -2.581 0 CA-C-N 115.139 -0.937 . . . . 73.12 112.076 -165.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.463 HD21 ' CE1' ' A' ' 62' ' ' PHE . 3.1 pp -167.67 157.46 10.35 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 124.385 1.053 . . . . 74.54 108.828 170.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.1 p -102.73 146.11 28.72 Favored 'General case' 0 N--CA 1.414 -2.262 0 N-CA-C 108.498 -0.927 . . . . 62.0 108.498 176.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.551 HD12 HD12 ' A' ' 74' ' ' LEU . 18.7 tp -63.61 -24.27 67.73 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.504 0.669 . . . . 51.31 109.425 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 ttp180 -47.97 -35.49 10.89 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.212 1.405 . . . . 75.23 110.081 172.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -82.6 -28.71 30.67 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.106 -0.952 . . . . 73.44 110.384 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.551 HD12 HD12 ' A' ' 71' ' ' LEU . 19.5 mt -80.0 -18.78 49.38 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.093 -0.958 . . . . 73.23 109.972 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -85.84 -36.1 20.22 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.058 -0.519 . . . . 73.04 110.092 171.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.73 74.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.941 -0.572 . . . . 52.13 110.637 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -130.6 82.01 66.1 Favored Pre-proline 0 N--CA 1.432 -1.343 0 N-CA-C 109.233 -0.655 . . . . 75.05 109.233 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.603 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 1.1 Cg_endo -82.99 86.09 1.5 Allowed 'Trans proline' 0 N--CA 1.429 -2.32 0 C-N-CA 121.177 1.252 . . . . 71.44 111.294 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.2 p -143.48 136.74 27.97 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.157 -1.794 . . . . 70.41 106.157 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.44 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 38.2 tp -51.35 -41.09 60.37 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 123.263 0.625 . . . . 75.04 111.177 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.63 -33.49 75.73 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.17 -0.923 . . . . 74.22 111.741 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.38 -47.8 66.41 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-O 119.418 -0.325 . . . . 53.33 111.517 -177.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.45 ' CG ' HD22 ' A' ' 74' ' ' LEU . 1.0 OUTLIER -61.79 -39.1 90.49 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 108.219 -1.03 . . . . 72.44 108.219 -176.052 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -61.54 -51.68 67.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.131 -1.395 . . . . 61.3 109.9 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.55 -27.1 64.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.751 -0.659 . . . . 73.33 111.816 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 78.1 mt -62.76 -33.6 75.49 Favored 'General case' 0 C--O 1.215 -0.718 0 N-CA-C 111.952 0.352 . . . . 73.42 111.952 177.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.529 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 51.4 mtt -59.15 -49.25 78.59 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.382 -0.527 . . . . 71.54 109.61 174.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.585 ' HA ' ' OE2' ' A' ' 93' ' ' GLU . 10.1 mp -64.8 -32.04 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.459 -0.791 . . . . 74.23 111.962 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.9 m -83.94 1.35 43.91 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.951 -0.568 . . . . 71.02 112.103 -177.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 43.0 mmt-85 -133.17 14.81 4.2 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.375 -0.602 . . . . 74.14 109.375 178.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.421 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 17.4 m -145.41 141.51 17.09 Favored Pre-proline 0 N--CA 1.446 -0.63 0 N-CA-C 111.802 0.297 . . . . 72.4 111.802 -176.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 91' ' ' SER . 2.4 Cg_endo -87.07 118.18 1.39 Allowed 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 121.897 1.731 . . . . 71.13 108.228 167.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.622 ' HB2' ' NE ' ' A' ' 16' ' ' ARG . 18.9 mt-10 . . . . . 0 C--O 1.263 1.814 0 N-CA-C 106.525 -1.657 . . . . 73.54 106.525 -177.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.732 ' N ' HE22 ' A' ' 85' ' ' GLN . 29.9 t70 . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 108.707 -0.849 . . . . 74.4 108.707 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -169.12 85.3 0.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.535 0.522 . . . . 62.31 110.771 178.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.371 0.1 OUTLIER -110.26 -68.89 0.9 Allowed 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 117.702 -1.599 . . . . 73.15 112.545 170.575 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.41 ' CE1' ' HA ' ' A' ' 93' ' ' GLU . 40.5 m170 -77.72 -20.88 52.76 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.786 -0.571 . . . . 71.15 112.522 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.17 -15.14 2.03 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.12 0.968 . . . . 31.2 113.308 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.86 -32.37 14.19 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.756 0.422 . . . . 63.23 111.002 172.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.477 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 16.2 t70 -58.76 -42.59 89.26 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.867 -0.79 . . . . 65.15 108.867 175.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.725 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 64.8 t80 -61.31 -21.1 63.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.434 1.093 . . . . 72.13 111.732 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 8.3 tt0 -62.12 -38.61 89.56 Favored 'General case' 0 C--O 1.193 -1.896 0 N-CA-C 108.494 -0.928 . . . . 70.21 108.494 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.45 ' HA ' ' HG2' ' A' ' 26' ' ' GLU . 6.8 tp-100 -64.24 -21.45 66.59 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.868 0.842 . . . . 64.15 109.994 179.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.615 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 7.4 tt -77.51 -24.5 50.05 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 116.02 -0.536 . . . . 74.21 109.615 175.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.484 HH21 ' CD ' ' A' ' 41' ' ' GLU . 5.0 mpt_? -73.41 -50.77 20.06 Favored 'General case' 0 CA--C 1.47 -2.099 0 N-CA-C 107.937 -1.135 . . . . 74.55 107.937 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 1.6 mm-40 -47.3 -46.75 25.37 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.774 1.921 . . . . 71.11 109.768 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -83.61 -31.8 26.06 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 115.858 -0.61 . . . . 62.53 112.018 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.615 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -58.14 -41.12 83.03 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 109.707 -0.479 . . . . 74.24 109.707 179.448 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 25' ' ' ARG . 73.7 mt -61.79 -32.71 54.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 115.126 -0.943 . . . . 71.55 110.058 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -80.01 -46.24 16.97 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.005 -0.543 . . . . 70.11 111.463 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -49.58 -53.54 23.25 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.359 1.244 . . . . 40.44 114.359 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 50' ' ' LEU . 85.0 mt -98.25 5.22 48.58 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 118.359 -1.336 . . . . 74.51 111.667 178.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.1 t30 54.35 72.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.252 1.025 . . . . 60.14 109.138 -173.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.0 mt -107.84 150.03 27.53 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.655 -1.157 . . . . 75.15 109.583 -173.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.2 p -88.81 159.87 45.12 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 107.726 -1.213 . . . . 73.44 107.726 174.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -67.33 -4.8 12.46 Favored 'Trans proline' 0 N--CA 1.492 1.416 0 C-N-CA 122.169 1.913 . . . . 73.52 113.722 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -97.95 -28.34 13.85 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.297 -1.001 . . . . 75.23 108.297 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -80.29 -37.61 32.4 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 114.9 -1.046 . . . . 70.4 108.62 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -104.97 85.78 2.34 Favored 'General case' 0 N--CA 1.412 -2.33 0 N-CA-C 106.86 -1.533 . . . . 73.33 106.86 175.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 t-80 -125.2 160.48 29.07 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 105.077 -2.194 . . . . 74.33 105.077 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.656 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 28.1 mm-40 -54.45 -48.09 72.14 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.507 0.67 . . . . 71.43 111.593 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -80.12 11.74 3.27 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 125.06 1.344 . . . . 75.32 112.665 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.43 ' O ' ' HA ' ' A' ' 79' ' ' THR . 32.3 t -92.61 140.43 29.55 Favored 'General case' 0 C--O 1.254 1.295 0 O-C-N 121.832 -0.543 . . . . 52.33 110.402 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.545 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 41.3 t-20 -85.05 108.8 17.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.631 0.729 . . . . 65.13 109.998 -178.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.5 mt -68.24 -23.04 64.74 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 114.917 1.451 . . . . 74.33 114.917 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.3 mm -77.8 -32.28 17.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 N-CA-C 108.756 -0.831 . . . . 62.32 108.756 177.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -77.74 -23.73 49.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.689 -0.687 . . . . 75.31 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.49 -24.91 62.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.76 -0.654 . . . . 75.21 109.611 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.25 36.2 3.68 Favored Glycine 0 N--CA 1.436 -1.3 0 CA-C-N 115.61 -0.723 . . . . 44.1 114.331 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.49 HD21 HD21 ' A' ' 28' ' ' LEU . 26.4 mt -63.48 111.94 2.55 Favored 'General case' 0 CA--C 1.484 -1.58 0 CA-C-N 117.706 0.753 . . . . 72.03 112.385 175.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.56 139.93 24.28 Favored 'General case' 0 C--O 1.249 1.05 0 CA-C-N 113.8 -1.545 . . . . 64.14 108.608 170.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.6 m -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 116.409 -0.359 . . . . 75.51 111.858 -175.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.488 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 50.4 mm -71.32 -40.3 73.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.562 0 C-N-CA 118.529 -1.268 . . . . 63.55 108.743 174.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -59.12 -43.31 91.93 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.474 -0.565 . . . . 74.13 109.474 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.513 ' HG ' HD11 ' A' ' 71' ' ' LEU . 12.7 tp -57.76 -44.43 86.14 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.71 -1.132 . . . . 74.43 109.749 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.9 mtt -85.17 -18.27 34.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.925 -0.579 . . . . 53.35 112.423 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.673 ' NE ' ' HA ' ' A' ' 57' ' ' ARG . 4.4 mmp_? -74.3 -36.75 63.77 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 109.46 -0.57 . . . . 74.34 109.46 174.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 4.3 m95 -62.98 -37.97 89.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.354 -0.839 . . . . 65.53 111.475 176.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.12 -36.05 72.37 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.512 0.672 . . . . 73.24 110.592 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -77.52 -38.05 49.66 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.018 -0.992 . . . . 74.33 108.684 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.477 ' HH2' ' O ' ' A' ' 20' ' ' ASP . 71.7 t90 -59.49 -35.97 75.14 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 114.935 -1.029 . . . . 74.44 111.217 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.582 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 40.2 m-85 -64.61 -54.32 33.84 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.345 1.069 . . . . 73.41 108.82 176.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -65.22 -13.22 57.78 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.742 -1.572 . . . . 71.14 114.116 -171.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.7 pttm -54.43 -33.67 59.91 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.046 0.538 . . . . 75.24 110.804 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -108.48 14.84 24.37 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.288 -0.634 . . . . 54.44 109.288 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.09 24.25 64.38 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.432 -0.89 . . . . 54.33 111.816 -176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.582 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 3.2 m-85 -72.13 162.72 29.06 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 121.508 0.67 . . . . 71.35 111.816 177.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -133.13 98.07 4.17 Favored 'General case' 0 C--N 1.28 -2.421 0 CA-C-N 115.201 -0.909 . . . . 72.05 110.877 -165.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.0 mt -144.68 151.56 39.13 Favored 'General case' 0 C--O 1.257 1.494 0 CA-C-N 116.414 -0.357 . . . . 62.04 111.071 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.433 ' HB ' ' HG3' ' A' ' 73' ' ' GLU . 1.5 m -105.39 141.98 35.94 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 106.17 -1.789 . . . . 41.21 106.17 173.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.564 HD12 HD12 ' A' ' 74' ' ' LEU . 29.7 tp -79.54 -26.09 41.53 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 120.58 -0.448 . . . . 64.35 110.776 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -66.3 -16.95 64.45 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 116.213 -0.449 . . . . 73.21 110.519 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.433 ' HG3' ' HB ' ' A' ' 70' ' ' THR . 45.3 mt-10 -83.83 -28.16 28.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.393 -0.822 . . . . 74.24 109.339 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.564 HD12 HD12 ' A' ' 71' ' ' LEU . 33.7 mt -78.92 -17.53 55.37 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.593 -1.185 . . . . 62.13 110.081 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -83.94 -38.73 20.67 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.158 -0.682 . . . . 74.14 109.158 171.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.29 -48.09 82.99 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.439 -0.8 . . . . 61.13 110.549 -177.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.38 85.57 55.57 Favored Pre-proline 0 N--CA 1.428 -1.562 0 N-CA-C 108.034 -1.099 . . . . 75.24 108.034 173.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.545 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 37.3 Cg_endo -85.06 86.34 1.14 Allowed 'Trans proline' 0 N--CA 1.417 -2.996 0 C-N-CA 120.851 1.034 . . . . 45.33 111.74 -176.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' A' ' 43' ' ' SER . 2.7 p -150.97 142.05 23.09 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 107.338 -1.356 . . . . 71.12 107.338 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 41' ' ' GLU . 57.0 tp -53.33 -44.28 68.32 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 124.151 0.907 . . . . 74.01 110.996 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.656 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -55.37 -40.01 70.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.872 -1.058 . . . . 72.54 111.806 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.29 68.11 Favored 'General case' 0 C--O 1.205 -1.264 0 CA-C-N 115.93 -0.577 . . . . 71.32 111.426 -176.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.434 ' CG ' HD22 ' A' ' 74' ' ' LEU . 4.2 m0 -61.76 -40.02 93.68 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 107.826 -1.176 . . . . 74.43 107.826 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 21.5 t30 -57.95 -56.07 26.74 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.411 -1.268 . . . . 61.41 111.081 177.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.732 HE22 ' N ' ' A' ' 14' ' ' ASP . 14.5 mm100 -72.61 -25.12 61.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.423 0.527 . . . . 54.1 112.423 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.0 mt -65.09 -30.73 71.69 Favored 'General case' 0 C--O 1.207 -1.164 0 C-N-CA 121.205 -0.198 . . . . 61.4 110.674 173.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.725 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 29.6 mtt -57.91 -45.32 86.66 Favored 'General case' 0 C--O 1.194 -1.865 0 C-N-CA 120.3 -0.56 . . . . 73.24 110.58 173.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.406 ' HG ' ' OD1' ' A' ' 14' ' ' ASP . 2.1 mm? -75.8 -14.97 60.31 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 112.687 0.625 . . . . 71.35 112.687 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 p -108.72 0.3 20.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 112.395 0.517 . . . . 70.51 112.395 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 46.9 mmt-85 -127.9 -28.8 2.63 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.107 0.479 . . . . 72.13 110.643 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.6 m -118.07 78.55 13.37 Favored Pre-proline 0 C--N 1.304 -1.383 0 N-CA-C 109.56 -0.534 . . . . 71.14 109.56 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -82.71 116.54 2.56 Favored 'Trans proline' 0 N--CA 1.423 -2.623 0 N-CA-C 107.099 -1.923 . . . . 71.11 107.099 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.41 ' HA ' ' CE1' ' A' ' 17' ' ' HIS . 0.9 OUTLIER . . . . . 0 N--CA 1.44 -0.949 0 O-C-N 125.035 1.459 . . . . 64.04 111.335 -178.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 107.497 -1.297 . . . . 71.42 107.497 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -87.7 -174.75 4.9 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.105 -1.072 . . . . 74.35 108.105 169.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.656 ' NH2' ' HA ' ' A' ' 93' ' ' GLU 0.335 0.0 OUTLIER -110.17 -75.51 0.62 Allowed 'General case' 0 CA--C 1.559 1.325 0 N-CA-C 115.839 1.792 . . . . 63.34 115.839 -173.766 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.595 ' HB2' ' OXT' ' A' ' 93' ' ' GLU . 4.4 t60 -69.03 -27.0 65.28 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 123.048 1.404 . . . . 63.04 107.867 177.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.5 -12.12 60.4 Favored 'General case' 0 C--O 1.181 -2.52 0 C-N-CA 127.722 2.409 . . . . 44.03 113.834 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -41.19 -25.06 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.241 0 N-CA-C 115.749 1.759 . . . . 62.35 115.749 -172.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.462 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 28.8 t70 -61.4 -35.85 78.66 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.951 -0.759 . . . . 73.23 108.951 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.611 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 78.8 t80 -60.51 -28.8 68.67 Favored 'General case' 0 CA--C 1.503 -0.829 0 C-N-CA 124.326 1.05 . . . . 62.35 110.567 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -61.34 -30.89 70.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 119.683 -0.807 . . . . 75.41 110.867 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 26.6 tp60 -70.62 -39.11 73.93 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.146 -1.057 . . . . 73.24 108.146 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.606 HD22 ' CE1' ' A' ' 21' ' ' TYR . 4.5 tt -64.83 -34.76 79.12 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.784 -0.45 . . . . 64.4 109.784 176.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.528 ' NH1' ' HB3' ' A' ' 80' ' ' LEU . 3.3 tpp180 -64.04 -48.49 76.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.004 -0.739 . . . . 72.13 109.004 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -55.18 -44.27 75.1 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 114.56 -1.2 . . . . 73.43 109.42 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 3.3 mmp_? -61.6 -56.23 22.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.136 -0.938 . . . . 73.11 111.28 176.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 28' ' ' LEU . 20.3 mt -51.66 -43.7 62.78 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.156 1.169 . . . . 74.13 114.156 -176.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.532 HG12 HD23 ' A' ' 39' ' ' LEU . 62.3 mt -66.65 -34.23 68.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.048 -0.524 . . . . 74.42 111.465 -177.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.03 -32.7 24.74 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.63 -0.428 . . . . 73.2 111.306 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -48.06 -53.65 15.72 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.162 0.801 . . . . 62.43 113.162 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.522 HD11 HD23 ' A' ' 50' ' ' LEU . 3.7 mp -107.75 11.51 28.22 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.097 -1.041 . . . . 73.2 111.778 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 57.01 46.54 19.17 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 122.231 1.015 . . . . 61.42 109.802 -176.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 60.6 mt -79.78 130.37 35.27 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.514 -1.221 . . . . 64.45 109.221 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.8 m -75.25 148.7 84.03 Favored Pre-proline 0 C--N 1.289 -2.065 0 N-CA-C 107.017 -1.475 . . . . 61.32 107.017 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -57.33 -21.08 42.61 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 C-N-CA 121.815 1.677 . . . . 73.23 111.954 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -85.24 -6.9 59.24 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.935 -0.575 . . . . 71.25 109.959 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.7 tp60 -104.89 -31.19 9.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 123.818 0.847 . . . . 63.44 108.725 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.532 HD23 HG12 ' A' ' 29' ' ' ILE . 21.1 tp -126.32 91.81 3.44 Favored 'General case' 0 N--CA 1.411 -2.416 0 CA-C-O 121.57 0.7 . . . . 51.13 111.758 -176.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.478 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 32.9 t-80 -115.24 166.77 11.48 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 106.594 -1.632 . . . . 73.23 106.594 173.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 6.6 mm-40 -42.73 -40.32 2.76 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 114.668 1.358 . . . . 64.13 114.668 -178.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.478 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -89.57 -6.13 56.59 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.812 -0.555 . . . . 74.2 111.426 -173.133 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.7 m -72.96 127.19 31.83 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-O 121.126 0.489 . . . . 52.25 110.879 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.499 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 54.9 m-80 -73.33 119.06 17.05 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.679 0.752 . . . . 72.3 112.274 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 18.8 mt -69.84 -26.42 64.21 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.832 -1.077 . . . . 73.42 112.893 -178.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.478 HG12 ' CB ' ' A' ' 78' ' ' PRO . 43.9 mm -72.88 -29.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 109.075 -0.713 . . . . 72.2 109.075 175.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -78.18 -23.91 47.42 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 109.718 -0.475 . . . . 74.03 109.718 177.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.8 -34.31 69.28 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.653 -0.703 . . . . 33.35 109.17 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.43 37.03 1.37 Allowed Glycine 0 N--CA 1.438 -1.226 0 C-N-CA 120.588 -0.815 . . . . 42.55 114.045 175.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.522 HD23 HD11 ' A' ' 32' ' ' LEU . 50.6 mt -68.77 114.94 7.56 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 117.473 0.636 . . . . 64.11 109.965 175.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -71.8 157.01 38.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 107.653 -1.24 . . . . 75.33 107.653 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.9 m -67.23 -14.9 63.34 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 113.708 1.003 . . . . 55.25 113.708 -174.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.533 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 49.4 mm -79.27 -44.19 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.275 0 C-N-CA 118.42 -1.312 . . . . 64.13 107.948 177.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.419 ' HG2' ' NH2' ' A' ' 57' ' ' ARG . 41.7 mtt180 -59.38 -43.63 92.86 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 108.44 -0.948 . . . . 73.43 108.44 176.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.37 -46.23 86.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.449 -1.251 . . . . 74.15 109.869 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 36.9 ttm -81.58 -19.03 42.8 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 112.662 0.615 . . . . 75.44 112.662 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 78.6 mtt180 -59.29 -47.49 85.17 Favored 'General case' 0 C--N 1.349 0.574 0 N-CA-C 106.202 -1.777 . . . . 63.44 106.202 173.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.442 ' HA ' ' HB3' ' A' ' 61' ' ' TRP . 8.0 m95 -59.33 -36.48 75.74 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 112.883 -1.962 . . . . 75.25 113.395 -174.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.18 -43.06 96.15 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.302 0.572 . . . . 71.25 110.496 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -74.98 -34.64 62.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.57 -0.741 . . . . 73.43 109.368 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.571 ' CH2' ' HB2' ' A' ' 24' ' ' LEU . 68.9 t90 -61.67 -35.25 77.44 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.719 -1.128 . . . . 73.41 110.453 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.496 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 28.4 m-85 -68.16 -52.2 37.24 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.399 1.095 . . . . 74.54 109.606 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -69.24 -13.09 62.21 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.076 -1.42 . . . . 72.34 114.084 -172.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.7 pttm -57.8 -32.83 67.93 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.028 0.442 . . . . 72.42 109.93 175.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -108.3 14.94 24.49 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 108.896 -0.779 . . . . 74.24 108.896 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.58 83.68 Favored Glycine 0 N--CA 1.427 -1.945 0 CA-C-N 114.998 -1.001 . . . . 61.32 113.181 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.496 ' HB2' ' HB3' ' A' ' 62' ' ' PHE . 21.1 m-85 -67.49 162.97 22.06 Favored 'General case' 0 CA--C 1.498 -1.056 0 CA-C-N 117.927 0.863 . . . . 73.42 111.936 175.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -112.74 58.84 0.64 Allowed 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 115.009 -0.996 . . . . 73.0 111.68 -167.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.7 mt -130.0 149.28 51.79 Favored 'General case' 0 CA--C 1.497 -1.093 0 C-N-CA 120.587 -0.445 . . . . 65.03 111.306 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 m -118.04 148.09 42.59 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 106.427 -1.694 . . . . 75.21 106.427 170.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.589 HD12 HD12 ' A' ' 74' ' ' LEU . 20.4 tp -76.05 -24.34 55.13 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.81 0.338 . . . . 74.03 111.051 -173.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.26 -21.75 62.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.143 0.497 . . . . 71.24 110.015 178.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -80.78 -32.38 35.45 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.135 -0.939 . . . . 55.34 109.182 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.589 HD12 HD12 ' A' ' 71' ' ' LEU . 48.8 mt -82.54 -17.86 43.51 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.572 -1.194 . . . . 71.13 110.791 -175.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -78.11 -34.51 50.0 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.308 -0.405 . . . . 74.02 109.92 170.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -72.54 -43.53 63.37 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.729 -0.668 . . . . 74.34 110.472 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -128.79 88.85 50.77 Favored Pre-proline 0 N--CA 1.433 -1.296 0 N-CA-C 108.725 -0.842 . . . . 72.54 108.725 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.499 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 37.9 Cg_endo -96.74 85.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.423 -2.667 0 C-N-CA 121.259 1.306 . . . . 62.15 113.267 -176.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.6 p -146.14 154.99 42.42 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 105.318 -2.105 . . . . 75.42 105.318 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.528 ' HB3' ' NH1' ' A' ' 25' ' ' ARG . 26.8 mt -54.07 -44.35 71.06 Favored 'General case' 0 C--O 1.249 1.027 0 CA-C-N 118.842 0.746 . . . . 72.1 110.814 177.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.434 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -51.88 -46.87 64.66 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 114.388 -1.278 . . . . 63.52 111.927 -177.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.74 99.51 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 112.341 0.497 . . . . 74.01 112.341 -177.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.458 ' CD1' HD22 ' A' ' 74' ' ' LEU . 2.6 m0 -68.59 -37.89 80.21 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 108.309 -0.997 . . . . 65.34 108.309 -176.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -68.04 -51.81 42.58 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.824 -1.08 . . . . 71.31 109.973 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -60.88 -41.31 95.75 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.263 1.025 . . . . 74.21 111.646 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.82 -36.37 80.94 Favored 'General case' 0 C--O 1.199 -1.557 0 CA-C-N 116.756 -0.202 . . . . 64.43 111.169 177.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.611 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 45.4 mtt -62.2 -48.35 80.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.038 -0.665 . . . . 74.51 111.115 175.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.33 -24.33 66.51 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.0 0.741 . . . . 75.14 113.0 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 p -94.17 6.04 49.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.43 0.633 . . . . 75.11 111.484 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -129.52 16.67 5.94 Favored 'General case' 0 C--O 1.248 1.016 0 N-CA-C 109.01 -0.737 . . . . 72.2 109.01 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.2 m -146.33 148.33 34.16 Favored Pre-proline 0 N--CA 1.432 -1.365 0 N-CA-C 108.776 -0.824 . . . . 65.34 108.776 -178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.25 117.38 3.79 Favored 'Trans proline' 0 N--CA 1.439 -1.691 0 N-CA-C 108.327 -1.451 . . . . 63.24 108.327 170.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.656 ' HA ' ' NH2' ' A' ' 16' ' ' ARG . 15.5 mm-40 . . . . . 0 C--O 1.279 2.658 0 O-C-N 125.152 1.532 . . . . 71.13 113.765 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.551 ' OD1' ' HG3' ' A' ' 16' ' ' ARG . 20.5 t70 . . . . . 0 CA--C 1.499 -0.997 0 N-CA-C 108.494 -0.928 . . . . 50.14 108.494 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -157.47 22.27 0.29 Allowed 'General case' 0 C--N 1.312 -1.044 0 O-C-N 124.302 1.001 . . . . 42.24 109.542 176.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.551 ' HG3' ' OD1' ' A' ' 14' ' ' ASP 0.486 0.0 OUTLIER -46.69 -74.13 0.04 OUTLIER 'General case' 0 C--N 1.373 1.607 0 N-CA-C 117.436 2.384 . . . . 74.44 117.436 -173.565 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -78.35 -21.02 50.12 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.67 0.747 . . . . 71.23 111.85 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.45 ' HB2' HD13 ' A' ' 88' ' ' LEU . . . -62.5 -16.13 53.95 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.164 -0.926 . . . . 74.11 111.69 179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.34 -34.46 33.89 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 122.333 0.253 . . . . 42.43 110.968 173.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.611 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 24.2 t70 -61.82 -40.72 96.27 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.358 0.599 . . . . 74.3 109.493 176.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.584 ' CE1' HD22 ' A' ' 24' ' ' LEU . 53.6 t80 -66.1 -22.39 66.4 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.807 -1.088 . . . . 72.4 112.084 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -65.45 -29.75 70.47 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.659 0.615 . . . . 73.32 112.659 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 10.0 pt20 -74.68 -19.54 60.22 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.642 -0.873 . . . . 75.33 108.642 178.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.584 HD22 ' CE1' ' A' ' 21' ' ' TYR . 5.2 tt -72.96 -38.95 66.56 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.85 -0.796 . . . . 74.24 108.85 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.439 HH21 ' HB3' ' A' ' 80' ' ' LEU . 1.6 mpt_? -58.44 -46.69 86.02 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 110.119 -0.326 . . . . 74.43 110.119 175.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -44.08 -52.89 6.84 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 125.168 1.542 . . . . 72.12 110.407 179.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -86.43 -32.02 21.09 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.207 -0.906 . . . . 72.14 113.141 -173.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.425 HD13 HD21 ' A' ' 80' ' ' LEU . 5.5 tt -59.55 -33.12 71.02 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 122.987 0.515 . . . . 55.34 110.269 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.455 HG12 HD23 ' A' ' 39' ' ' LEU . 77.4 mt -64.88 -33.29 62.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.647 -0.706 . . . . 72.05 111.493 178.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -81.81 -29.8 32.49 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 121.753 -0.592 . . . . 74.23 111.299 176.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.447 ' CD ' ' HE ' ' A' ' 54' ' ' ARG . 6.6 mm-40 -54.77 -54.11 46.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.268 0.84 . . . . 74.43 113.268 -177.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.467 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 4.7 mp -95.89 7.88 45.12 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.39 -0.524 . . . . 74.23 111.793 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.7 t30 57.83 65.78 1.25 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.835 1.302 . . . . 62.25 108.732 -173.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.467 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 49.6 mt -108.14 -176.11 2.96 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 113.986 -1.461 . . . . 64.31 108.281 -177.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.1 m -146.39 148.13 33.33 Favored Pre-proline 0 C--N 1.277 -2.562 0 N-CA-C 104.277 -2.49 . . . . 75.03 104.277 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -55.55 -28.61 65.74 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 C-N-CA 122.056 1.838 . . . . 74.13 112.633 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mp0 -75.22 -12.19 60.24 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.014 0.435 . . . . 71.04 110.99 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -102.09 -40.63 6.74 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.228 -0.656 . . . . 65.14 109.228 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.493 HD21 HD11 ' A' ' 80' ' ' LEU . 51.2 tp -109.47 94.57 5.1 Favored 'General case' 0 N--CA 1.412 -2.361 0 CA-C-N 115.346 -0.843 . . . . 72.33 112.774 -173.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -102.67 165.12 11.25 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 104.759 -2.312 . . . . 72.35 104.759 168.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.435 ' CD ' HH22 ' A' ' 25' ' ' ARG 0.378 12.0 pt-20 -76.45 -1.45 27.15 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 117.994 2.59 . . . . 72.24 117.994 -169.969 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.33 -9.41 35.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.936 -0.765 . . . . 64.1 108.936 178.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.1 m -68.77 132.92 47.61 Favored 'General case' 0 N--CA 1.425 -1.713 0 CA-C-N 114.851 -1.068 . . . . 72.32 111.287 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.574 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 39.8 t-20 -77.11 114.14 15.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.495 -0.775 . . . . 65.32 110.453 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.496 HD11 HD23 ' A' ' 80' ' ' LEU . 86.9 mt -70.14 -29.85 66.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 114.157 1.169 . . . . 71.15 114.157 -175.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.415 HG12 ' CB ' ' A' ' 78' ' ' PRO . 39.8 mm -72.02 -34.05 49.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 C-N-CA 120.153 -0.619 . . . . 71.33 109.67 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -78.47 -13.38 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.871 -0.604 . . . . 70.12 110.38 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -88.48 -9.75 51.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.636 -0.711 . . . . 73.45 109.152 175.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 88.09 36.79 8.09 Favored Glycine 0 N--CA 1.437 -1.291 0 CA-C-N 115.306 -0.861 . . . . 60.21 113.775 177.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.0 106.1 9.64 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.032 -1.099 . . . . 60.14 108.032 176.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.604 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.6 p30 -63.2 157.18 23.2 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 114.501 -1.227 . . . . 73.42 111.383 -177.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -68.0 -14.38 62.92 Favored 'General case' 0 N--CA 1.423 -1.825 0 N-CA-C 113.561 0.949 . . . . 72.22 113.561 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.507 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.1 mm -80.36 -38.87 18.38 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.44 0 C-N-CA 117.964 -1.495 . . . . 74.32 107.921 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.604 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 2.1 mpt_? -57.08 -47.16 81.7 Favored 'General case' 0 CA--C 1.492 -1.264 0 N-CA-C 108.715 -0.846 . . . . 63.35 108.715 173.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' HG ' HD11 ' A' ' 71' ' ' LEU . 5.3 tp -59.13 -43.11 91.95 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 113.724 -1.58 . . . . 72.42 109.876 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.9 tpp -75.33 -33.86 61.17 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-N 116.207 -0.451 . . . . 62.32 110.964 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.507 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 42.5 mtm180 -64.44 -43.0 95.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 109.312 -0.625 . . . . 74.12 109.312 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -65.03 -37.9 89.13 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.113 -0.949 . . . . 72.5 111.852 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.5 tp -54.64 -35.2 63.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.534 0.683 . . . . 75.23 111.284 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -81.43 -36.45 29.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.955 -0.566 . . . . 74.03 110.278 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.447 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 75.2 t90 -61.25 -40.57 94.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.557 -0.747 . . . . 72.0 110.788 178.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.512 ' CD1' HD11 ' A' ' 69' ' ' LEU . 52.7 m-85 -63.06 -53.35 55.06 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 122.098 0.951 . . . . 54.34 111.487 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -67.94 -12.69 61.22 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 114.542 -1.208 . . . . 73.34 113.607 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 23.3 pttm -54.58 -33.7 60.71 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.727 0.411 . . . . 75.12 110.722 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -108.32 10.68 27.6 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.574 -0.528 . . . . 73.44 109.574 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.38 33.89 38.02 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.8 -0.714 . . . . 71.53 112.687 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -74.47 146.84 42.46 Favored 'General case' 0 CA--C 1.485 -1.555 0 C-N-CA 119.527 -0.869 . . . . 71.14 112.155 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.42 HH21 ' HB3' ' A' ' 86' ' ' LEU . 0.1 OUTLIER -102.21 102.59 13.02 Favored 'General case' 0 N--CA 1.418 -2.054 0 CA-C-N 114.488 -1.233 . . . . 64.21 110.391 -170.503 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.512 HD11 ' CD1' ' A' ' 62' ' ' PHE . 3.9 pp -168.59 144.5 3.6 Favored 'General case' 0 C--N 1.313 -1.008 0 O-C-N 124.1 0.875 . . . . 72.2 111.22 167.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.4 p -100.42 146.91 26.44 Favored 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 106.029 -1.841 . . . . 62.41 106.029 169.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.528 HD12 HD12 ' A' ' 74' ' ' LEU . 13.9 tp -64.71 -24.54 67.6 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.334 0.587 . . . . 73.35 110.055 -177.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -48.53 -34.42 11.31 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 125.332 1.453 . . . . 51.23 110.249 173.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -82.49 -28.4 31.18 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.064 -0.971 . . . . 74.15 110.375 -175.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.528 HD12 HD12 ' A' ' 71' ' ' LEU . 23.2 mt -80.17 -20.08 45.63 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.183 -0.917 . . . . 71.23 110.432 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -79.72 -34.14 40.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 74.52 109.839 171.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.81 65.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.694 -0.684 . . . . 60.21 110.552 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.92 85.77 58.8 Favored Pre-proline 0 C--N 1.309 -1.152 0 N-CA-C 109.087 -0.709 . . . . 71.21 109.087 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.574 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 17.5 Cg_endo -89.45 86.9 0.43 Allowed 'Trans proline' 0 N--CA 1.422 -2.697 0 C-N-CA 121.245 1.297 . . . . 71.42 112.986 -176.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.5 p -149.75 144.29 25.96 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 104.83 -2.285 . . . . 62.31 104.83 175.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 45' ' ' LEU . 67.0 mt -55.33 -39.46 70.02 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 118.743 0.701 . . . . 74.33 111.866 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -56.52 -40.12 74.49 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.164 -0.926 . . . . 72.51 111.976 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.13 -40.75 82.39 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.618 -0.23 . . . . 73.22 111.103 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.459 ' CD1' HD22 ' A' ' 74' ' ' LEU . 5.1 m0 -62.1 -45.23 94.41 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 107.477 -1.305 . . . . 74.12 107.477 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.426 ' O ' ' HG2' ' A' ' 87' ' ' MET . 28.9 t30 -56.56 -53.55 56.3 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 113.912 -1.495 . . . . 63.42 110.211 177.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -60.61 -48.01 83.68 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.604 -0.725 . . . . 75.24 112.442 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 92.7 mt -59.53 -35.21 73.76 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 112.786 0.662 . . . . 71.24 112.786 -177.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.426 ' HG2' ' O ' ' A' ' 84' ' ' ASN . 20.4 ptm -82.1 -45.05 15.74 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.513 -0.475 . . . . 63.15 110.411 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.533 HD11 ' HD2' ' A' ' 16' ' ' ARG . 18.8 tp -72.58 -13.53 61.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 113.734 1.012 . . . . 75.04 113.734 -176.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.9 m -63.56 -24.86 67.98 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.465 0.65 . . . . 73.24 110.247 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.464 ' NE ' ' HA ' ' A' ' 90' ' ' ARG . 0.2 OUTLIER -132.55 -59.07 0.92 Allowed 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 113.565 0.95 . . . . 74.31 113.565 176.355 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.7 m 54.92 -174.88 0.02 OUTLIER Pre-proline 0 CA--C 1.578 2.041 0 O-C-N 124.12 0.887 . . . . 55.4 110.393 -171.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -81.57 116.69 2.95 Favored 'Trans proline' 0 N--CA 1.446 -1.307 0 N-CA-C 107.239 -1.869 . . . . 74.12 107.239 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 . . . . . 0 N--CA 1.427 -1.581 0 N-CA-C 106.809 -1.552 . . . . 75.02 106.809 -172.026 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.696 ' N ' HE22 ' A' ' 85' ' ' GLN . 11.1 p-10 . . . . . 0 CA--C 1.508 -0.669 0 N-CA-C 106.524 -1.658 . . . . 50.53 106.524 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -169.15 105.03 0.39 Allowed 'General case' 0 C--O 1.219 -0.523 0 O-C-N 123.463 0.477 . . . . 73.33 109.852 176.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.405 ' HD3' HD12 ' A' ' 88' ' ' LEU 0.339 0.0 OUTLIER -110.72 -69.19 0.88 Allowed 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 119.237 -0.985 . . . . 74.01 112.216 168.76 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.2 m-70 -78.65 -21.08 48.89 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.974 0.731 . . . . 73.31 112.974 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.05 -15.33 8.9 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 113.701 1.0 . . . . 45.21 113.701 -176.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.66 -30.2 5.22 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 122.974 0.51 . . . . 53.33 111.326 172.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.466 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 27.3 t70 -63.33 -43.55 97.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.1 -1.074 . . . . 71.33 108.1 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.603 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 82.6 t80 -66.58 -23.01 66.14 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.114 -0.948 . . . . 75.25 110.598 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -65.25 -34.03 77.4 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.986 -0.746 . . . . 62.31 108.986 176.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -73.45 -23.75 60.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.781 -0.645 . . . . 75.32 109.79 175.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HB2' ' CH2' ' A' ' 61' ' ' TRP . 4.3 tt -65.88 -26.66 67.73 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.722 -0.473 . . . . 75.01 109.722 173.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.607 ' NH2' ' HB3' ' A' ' 80' ' ' LEU . 2.2 mpt_? -64.81 -44.5 89.67 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 120.53 -0.468 . . . . 73.34 111.158 175.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -52.92 -51.13 62.4 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.202 0.939 . . . . 71.11 108.835 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.425 ' NE ' ' HA ' ' A' ' 27' ' ' ARG . 3.6 mmp_? -65.55 -44.04 88.06 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.124 -0.944 . . . . 73.52 111.522 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -62.49 -36.6 83.02 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.357 0.663 . . . . 73.5 111.913 -177.303 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 25' ' ' ARG . 82.9 mt -64.71 -32.88 59.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.983 0.421 . . . . 63.1 110.284 179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -84.1 -31.37 25.32 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 110.104 -0.332 . . . . 73.45 110.104 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.402 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 9.0 tp10 -50.36 -54.19 23.47 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.245 1.418 . . . . 62.33 112.423 -178.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 95.2 mt -103.54 3.36 34.62 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 119.585 -0.846 . . . . 72.12 111.567 176.433 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 t30 56.45 69.13 0.77 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.656 1.217 . . . . 72.3 108.241 -172.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 41.1 mt -99.14 141.78 31.47 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.12 -1.4 . . . . 74.45 110.75 -172.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.6 m -79.44 146.13 65.27 Favored Pre-proline 0 C--N 1.292 -1.934 0 N-CA-C 106.237 -1.764 . . . . 75.12 106.237 175.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.98 -22.01 52.79 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 121.903 1.735 . . . . 63.21 112.677 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -88.47 -2.08 58.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.332 0.587 . . . . 74.51 110.37 177.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -112.28 -14.01 13.39 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 108.111 -1.07 . . . . 42.33 108.111 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.466 ' CD1' HD11 ' A' ' 80' ' ' LEU . 2.6 tm? -136.82 82.37 1.93 Allowed 'General case' 0 N--CA 1.418 -2.033 0 CA-C-O 122.105 0.955 . . . . 74.45 109.379 -178.115 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 36.8 t-80 -119.63 165.92 13.84 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 106.347 -1.723 . . . . 70.41 106.347 173.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' A' ' 81' ' ' ALA . 20.2 tp10 -43.95 -34.93 1.83 Allowed 'General case' 0 CA--C 1.573 1.86 0 C-N-CA 125.636 1.574 . . . . 75.05 113.347 -175.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.487 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -0.9 38.6 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.525 -0.735 . . . . 74.12 111.662 -173.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.2 m -69.52 138.21 53.13 Favored 'General case' 0 C--O 1.256 1.44 0 CA-C-O 121.409 0.623 . . . . 54.44 112.071 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.504 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.9 t-20 -82.32 112.99 19.8 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.441 -0.8 . . . . 70.44 110.235 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.528 ' HB3' HD12 ' A' ' 50' ' ' LEU . 80.4 mt -69.03 -34.16 74.78 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 114.536 1.31 . . . . 54.21 114.536 -175.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.5 mt -84.37 -19.8 9.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.662 0 CA-C-O 121.742 0.782 . . . . 74.02 109.664 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -76.33 -34.17 59.0 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.675 -1.232 . . . . 70.53 107.675 173.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.23 -35.73 74.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.26 -0.882 . . . . 74.2 110.213 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.1 25.57 0.8 Allowed Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 119.489 -1.339 . . . . 64.55 115.65 174.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 45' ' ' LEU . 30.6 mt -70.61 108.93 4.59 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.616 1.208 . . . . 74.33 111.344 175.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.7 p30 -68.86 167.89 14.67 Favored 'General case' 0 C--O 1.246 0.913 0 N-CA-C 108.749 -0.834 . . . . 73.31 108.749 174.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 18.7 m -75.98 -14.64 60.23 Favored 'General case' 0 N--CA 1.423 -1.787 0 N-CA-C 114.754 1.39 . . . . 63.51 114.754 -174.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.549 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 47.8 mm -75.16 -45.8 40.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.467 0 N-CA-C 106.495 -1.668 . . . . 63.13 106.495 176.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -54.57 -44.39 72.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 123.675 0.61 . . . . 71.31 110.055 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.509 ' HB3' HD11 ' A' ' 71' ' ' LEU . 42.1 mt -53.2 -51.45 62.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.363 -0.835 . . . . 75.25 111.292 175.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.0 ptp -81.36 -18.6 45.04 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.301 0.852 . . . . 75.21 113.301 -177.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 30.7 mtm180 -64.55 -40.12 94.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.855 -1.165 . . . . 73.04 107.855 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -65.82 -34.17 77.53 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.545 -1.207 . . . . 72.23 111.713 176.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.4 tp -58.0 -38.83 76.85 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.147 0.499 . . . . 71.45 110.881 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.84 -41.63 64.61 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.401 -0.818 . . . . 71.04 108.896 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.586 ' CH2' ' HB2' ' A' ' 24' ' ' LEU . 62.2 t90 -55.41 -42.96 74.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.419 1.088 . . . . 62.33 111.086 -178.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.451 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 26.2 m-85 -58.75 -40.71 84.65 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 122.446 1.117 . . . . 65.15 110.669 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.273 76.1 mtt180 -70.52 -12.19 61.41 Favored 'General case' 0 C--N 1.276 -2.61 0 CA-C-N 114.273 -1.33 . . . . 73.23 114.139 -170.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 9.6 mtmp? -46.31 -50.09 16.71 Favored 'General case' 0 N--CA 1.504 2.243 0 CA-C-O 121.723 0.773 . . . . 72.32 110.829 174.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.422 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 2.5 m-20 -99.01 9.0 44.46 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 114.702 -1.136 . . . . 62.31 109.842 -172.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.23 28.37 45.06 Favored Glycine 0 N--CA 1.426 -2.028 0 C-N-CA 120.638 -0.791 . . . . 70.12 112.305 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' HB2' ' HB3' ' A' ' 62' ' ' PHE . 44.3 m-85 -72.53 155.8 39.69 Favored 'General case' 0 CA--C 1.481 -1.695 0 C-N-CA 119.325 -0.95 . . . . 71.11 109.706 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -129.46 82.7 2.09 Favored 'General case' 0 C--N 1.27 -2.862 0 CA-C-N 115.165 -0.925 . . . . 74.2 111.873 -165.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.4 mt -127.91 153.27 46.87 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 115.703 -0.681 . . . . 73.52 111.223 -178.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.5 p -113.75 142.41 46.08 Favored 'General case' 0 N--CA 1.42 -1.973 0 N-CA-C 106.266 -1.753 . . . . 72.12 106.266 169.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.583 HD12 HD12 ' A' ' 74' ' ' LEU . 16.6 tp -66.96 -24.14 66.03 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.302 0.572 . . . . 54.22 110.203 -176.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -44.94 -35.13 2.7 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.817 1.647 . . . . 60.0 110.984 174.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.469 ' CD ' HH22 ' A' ' 90' ' ' ARG . 30.2 mt-10 -86.03 -28.04 24.41 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.926 -1.034 . . . . 75.24 110.43 -173.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.583 HD12 HD12 ' A' ' 71' ' ' LEU . 31.4 mt -81.43 -20.0 41.3 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.712 -1.131 . . . . 72.34 110.083 -174.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -79.99 -37.61 33.89 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.61 -0.723 . . . . 74.4 109.415 171.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -64.74 -46.63 81.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.455 -0.793 . . . . 73.5 110.988 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -128.37 85.8 59.48 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 109.601 -0.518 . . . . 74.23 109.601 176.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.504 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 2.9 Cg_endo -82.6 86.24 1.52 Allowed 'Trans proline' 0 N--CA 1.426 -2.454 0 C-N-CA 121.155 1.237 . . . . 75.43 111.47 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.7 p -153.9 140.95 19.36 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.651 -1.611 . . . . 74.31 106.651 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.607 ' HB3' ' NH2' ' A' ' 25' ' ' ARG . 77.9 mt -50.22 -48.84 54.24 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 123.981 0.801 . . . . 74.43 111.706 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.469 ' HA ' ' OE1' ' A' ' 41' ' ' GLU . . . -46.3 -46.54 18.1 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 124.962 1.414 . . . . 64.11 112.887 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.519 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.17 -48.44 62.2 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-O 119.09 -0.481 . . . . 64.31 111.19 -177.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.524 ' CG ' HD22 ' A' ' 74' ' ' LEU . 3.9 m0 -60.53 -38.79 85.58 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.245 -1.02 . . . . 75.31 108.245 -178.246 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.34 -59.24 5.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.11 -1.405 . . . . 72.22 109.903 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.696 HE22 ' N ' ' A' ' 14' ' ' ASP . 6.8 tp-100 -63.84 -26.44 68.62 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 123.707 0.803 . . . . 73.41 111.845 -178.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 83.3 mt -67.23 -25.67 66.21 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 111.91 0.337 . . . . 63.21 111.91 176.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.603 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 50.3 mtt -71.14 -22.69 62.03 Favored 'General case' 0 C--O 1.2 -1.533 0 C-N-CA 120.392 -0.523 . . . . 73.34 110.005 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.405 HD12 ' HD3' ' A' ' 16' ' ' ARG . 1.2 mm? -93.51 -12.0 30.66 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 121.071 0.463 . . . . 64.21 110.735 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.8 t -67.57 -31.08 70.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 107.253 -1.388 . . . . 72.03 107.253 171.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.488 ' HD3' ' N ' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -167.78 101.06 0.48 Allowed 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 114.782 -1.099 . . . . 72.33 110.142 174.219 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 55.4 m -81.39 -164.22 0.05 OUTLIER Pre-proline 0 C--N 1.308 -1.204 0 N-CA-C 105.917 -1.883 . . . . 61.21 105.917 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -73.12 114.38 4.02 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 CA-C-N 123.263 2.201 . . . . 52.4 106.578 168.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.267 2.006 0 N-CA-C 105.612 -1.996 . . . . 63.42 105.612 -171.261 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.625 ' OD2' ' HG3' ' A' ' 16' ' ' ARG . 15.4 t0 . . . . . 0 CA--C 1.5 -0.958 0 N-CA-C 108.045 -1.094 . . . . 73.41 108.045 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -170.97 22.57 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.978 0 O-C-N 124.393 1.058 . . . . 73.51 109.818 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.625 ' HG3' ' OD2' ' A' ' 14' ' ' ASP 0.306 0.0 OUTLIER -51.13 -45.53 61.64 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 115.354 1.613 . . . . 72.43 115.354 -176.366 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.509 ' H ' ' HD2' ' A' ' 16' ' ' ARG . 88.1 m-70 -78.72 -39.69 35.71 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.956 0.884 . . . . 75.0 111.093 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.76 -16.23 62.71 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.761 -1.109 . . . . 71.04 113.694 -174.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.07 -26.41 60.34 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.516 -0.311 . . . . 73.1 110.645 173.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.473 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 17.7 t70 -81.14 -42.83 20.29 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.2 -1.407 . . . . 73.21 107.2 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.623 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 60.7 t80 -54.48 -35.99 63.67 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.108 0.963 . . . . 72.21 112.162 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.655 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 52.3 tp60 -45.17 -52.29 9.51 Favored 'General case' 0 C--O 1.209 -1.074 0 O-C-N 124.376 1.048 . . . . 65.03 109.662 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.57 -33.23 71.17 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.44 0.696 . . . . 73.51 111.927 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 4.6 tt -66.25 -34.91 79.08 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.136 -0.69 . . . . 64.0 109.136 177.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.62 HH12 ' NE2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -83.91 -34.93 24.42 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 115.521 -0.763 . . . . 73.01 110.903 -172.589 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 1.4 mm-40 -63.51 -37.53 87.65 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.286 -1.005 . . . . 72.41 108.286 178.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 ttt85 -73.36 -37.4 66.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 120.024 -0.67 . . . . 73.21 110.589 173.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.551 HD13 ' CD1' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -56.42 -30.21 62.53 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.24 0.459 . . . . 73.52 112.24 -177.246 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.71 -50.41 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-O 121.317 0.579 . . . . 74.24 109.711 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -70.9 -33.22 70.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.696 -0.684 . . . . 65.53 111.259 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.405 ' CD ' ' HD2' ' A' ' 54' ' ' ARG . 9.1 tp10 -47.33 -53.26 14.12 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 125.556 1.542 . . . . 63.13 112.464 -175.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' HB2' ' CD1' ' A' ' 34' ' ' LEU . 82.8 mt -107.92 10.16 28.54 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.036 -0.666 . . . . 73.03 110.911 176.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 60.56 42.22 14.43 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 121.892 0.853 . . . . 75.14 110.404 -176.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' CD1' ' HB2' ' A' ' 32' ' ' LEU . 1.5 mp -79.65 130.93 35.8 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 108.055 -1.091 . . . . 71.24 108.055 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.512 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 74.9 p -79.65 157.61 74.34 Favored Pre-proline 0 C--N 1.296 -1.733 0 N-CA-C 107.933 -1.136 . . . . 53.34 107.933 176.452 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -63.55 -1.7 3.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.457 2.105 . . . . 73.22 112.793 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -84.19 -26.19 28.95 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.539 -0.911 . . . . 41.23 108.539 177.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 35' ' ' THR . 15.5 pt20 -115.07 -14.09 11.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.561 -0.745 . . . . 54.13 110.432 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -108.15 94.25 4.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.931 0.872 . . . . 65.31 110.461 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.473 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 25.2 t-80 -130.73 164.53 24.89 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 102.658 -3.089 . . . . 71.44 102.658 167.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.454 ' HA ' ' HB3' ' A' ' 80' ' ' LEU 0.5 9.1 pt-20 -77.87 -2.36 36.28 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 118.63 2.826 . . . . 75.24 118.63 -169.519 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -91.63 -7.3 50.41 Favored 'General case' 0 C--N 1.314 -0.949 0 O-C-N 121.26 -0.9 . . . . 74.32 108.711 177.791 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.7 t -66.52 140.09 57.97 Favored 'General case' 0 C--O 1.263 1.77 0 CA-C-N 114.858 -1.064 . . . . 74.14 111.186 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -86.6 111.92 21.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.224 -0.898 . . . . 74.03 108.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.4 mt -74.3 -21.36 59.76 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 113.446 0.906 . . . . 61.14 113.446 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.6 mm -71.83 -36.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.429 -0.952 . . . . 54.11 108.429 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -79.19 -17.43 54.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.082 -0.963 . . . . 75.25 109.808 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.44 -16.83 44.29 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.411 -0.813 . . . . 52.1 109.824 177.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.64 26.55 7.56 Favored Glycine 0 N--CA 1.435 -1.423 0 CA-C-N 115.55 -0.75 . . . . 74.23 114.654 175.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 tp -74.62 116.81 15.74 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 106.109 -1.811 . . . . 73.31 106.109 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -78.04 164.62 24.88 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 119.561 -0.856 . . . . 72.41 109.7 -174.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 7.6 m -70.65 -19.86 62.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 112.708 0.633 . . . . 75.52 112.708 -176.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.601 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 48.9 mm -76.67 -42.05 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 N-CA-C 106.946 -1.501 . . . . 74.14 106.946 176.052 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HD2' ' CD ' ' A' ' 31' ' ' GLU . 1.6 tpp180 -54.82 -48.06 73.28 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.931 -1.137 . . . . 65.42 107.931 176.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.54 -47.35 79.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 113.341 -1.754 . . . . 74.51 110.397 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 19.8 ptp -81.66 -18.69 43.68 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.152 -0.619 . . . . 70.33 111.935 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.601 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 6.1 mmp_? -63.85 -40.5 96.72 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.662 -1.236 . . . . 74.15 107.662 176.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.586 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 10.8 m95 -60.93 -35.43 76.7 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.072 -1.422 . . . . 70.42 113.095 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.82 -39.13 70.92 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.497 0.665 . . . . 72.41 109.942 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -70.77 -30.67 67.22 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.857 -1.065 . . . . 55.43 109.702 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.518 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 41.0 t90 -71.09 -33.91 70.63 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.739 -0.664 . . . . 72.33 109.927 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.569 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 79.1 m-85 -68.29 -59.19 3.38 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.62 -0.881 . . . . 73.21 108.62 173.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -53.83 -24.47 15.7 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 114.373 -1.285 . . . . 73.23 112.214 -176.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 2.1 ttpm? -41.82 -50.45 4.37 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 127.041 2.136 . . . . 64.5 112.77 173.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -114.82 29.11 8.26 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 122.747 1.26 . . . . 74.23 109.281 -171.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 89.72 -11.08 71.41 Favored Glycine 0 C--O 1.248 0.978 0 CA-C-N 114.876 -1.056 . . . . 64.52 113.154 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.569 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 34.6 m-85 -61.09 159.55 11.6 Favored 'General case' 0 CA--C 1.486 -1.493 0 C-N-CA 123.088 0.555 . . . . 73.32 111.206 -178.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.587 ' NH1' ' HB2' ' A' ' 93' ' ' GLU . 16.7 ptp180 -153.19 135.31 14.82 Favored 'General case' 0 C--N 1.278 -2.514 0 C-N-CA 118.996 -1.082 . . . . 63.3 112.545 -166.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -168.48 176.45 5.76 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.039 -1.467 . . . . 74.05 107.039 168.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.5 p -113.2 142.1 46.18 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 108.128 -1.064 . . . . 72.14 108.128 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.526 HD12 HD12 ' A' ' 74' ' ' LEU . 17.9 tp -66.32 -24.33 66.52 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.115 0.483 . . . . 74.45 111.489 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.4 ppt_? -60.7 -15.76 32.42 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.779 -0.646 . . . . 75.05 110.758 178.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -86.09 -26.46 25.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.772 -0.649 . . . . 74.32 110.136 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.526 HD12 HD12 ' A' ' 71' ' ' LEU . 16.1 mt -82.12 -22.99 35.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.469 -0.787 . . . . 64.12 110.19 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -84.24 -32.17 24.6 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.665 -0.698 . . . . 71.43 109.718 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.35 -47.37 73.64 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.048 -0.524 . . . . 52.22 110.294 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.34 86.47 57.01 Favored Pre-proline 0 N--CA 1.432 -1.357 0 N-CA-C 108.282 -1.007 . . . . 53.55 108.282 175.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -80.77 86.47 1.64 Allowed 'Trans proline' 0 N--CA 1.427 -2.422 0 C-N-CA 121.039 1.159 . . . . 72.25 111.942 -176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.3 p -153.25 140.83 19.86 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.21 -1.404 . . . . 72.01 107.21 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.551 ' CD1' HD13 ' A' ' 28' ' ' LEU . 31.1 tp -52.43 -49.8 63.83 Favored 'General case' 0 C--N 1.289 -2.04 0 O-C-N 124.237 0.961 . . . . 50.31 111.322 -177.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.446 ' N ' ' HB2' ' A' ' 41' ' ' GLU . . . -54.95 -35.05 63.83 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.062 0.945 . . . . 75.32 112.407 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.568 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -60.59 -46.0 91.89 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 121.281 -0.168 . . . . 71.1 110.757 -178.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.504 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -65.94 -38.27 88.2 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 107.936 -1.135 . . . . 70.32 107.936 -176.865 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -62.28 -51.7 66.67 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 113.921 -1.49 . . . . 73.12 110.06 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.92 -28.66 64.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.684 -0.689 . . . . 72.24 111.352 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 73.3 mt -59.51 -34.6 72.82 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 112.132 0.419 . . . . 64.31 112.132 177.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.623 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 40.5 mtt -55.17 -55.7 28.23 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.167 0.508 . . . . 72.51 110.433 174.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.37 -38.81 88.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.312 -0.858 . . . . 63.15 112.163 177.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.4 m -68.22 -35.82 78.55 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 116.198 -0.456 . . . . 62.51 111.882 -177.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 16.4 mmm-85 -78.29 -48.43 15.71 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.555 -0.458 . . . . 74.42 111.1 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.443 ' HB3' ' CD ' ' A' ' 92' ' ' PRO . 66.7 m 59.79 -172.91 0.02 OUTLIER Pre-proline 0 CA--C 1.583 2.245 0 O-C-N 123.88 0.738 . . . . 61.42 110.41 -176.345 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.443 ' CD ' ' HB3' ' A' ' 91' ' ' SER . 3.0 Cg_exo -80.52 118.51 3.56 Favored 'Trans proline' 0 C--N 1.363 1.313 0 CA-C-N 120.848 1.339 . . . . 75.12 111.01 172.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.587 ' HB2' ' NH1' ' A' ' 68' ' ' ARG . 7.2 mt-10 . . . . . 0 C--O 1.283 2.837 0 N-CA-C 105.751 -1.944 . . . . 71.13 105.751 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 CA--C 1.518 -0.285 0 N-CA-C 106.131 -1.803 . . . . 73.33 106.131 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -140.66 24.61 2.22 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.488 -0.768 . . . . 54.23 112.269 -177.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.486 ' HD3' HD12 ' A' ' 88' ' ' LEU 0.284 0.0 OUTLIER -57.01 -49.38 75.96 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.957 1.095 . . . . 74.02 113.957 -174.435 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.08 -36.52 48.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.582 0.706 . . . . 74.13 110.3 177.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.657 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -61.45 -15.98 42.53 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 114.376 1.25 . . . . 75.42 114.376 -174.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.84 -29.51 62.92 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 120.835 0.35 . . . . 53.24 110.961 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.526 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 27.6 t70 -70.86 -36.93 73.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 108.731 -0.84 . . . . 73.41 108.731 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.564 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 48.3 t80 -62.9 -22.71 66.93 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.314 -0.857 . . . . 65.45 111.366 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -59.17 -33.94 71.52 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.124 0.487 . . . . 73.32 109.845 178.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -69.66 -38.39 77.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.652 -0.87 . . . . 54.3 108.652 177.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.517 HD22 ' CE2' ' A' ' 21' ' ' TYR . 5.0 tt -67.59 -26.52 66.31 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.935 -0.575 . . . . 74.11 110.343 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.557 ' HD3' HD11 ' A' ' 80' ' ' LEU . 22.3 mmm-85 -59.36 -56.6 19.98 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.58 -0.526 . . . . 73.53 109.58 171.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.54 ' OE1' ' HD2' ' A' ' 27' ' ' ARG . 5.1 tm-20 -50.7 -47.85 58.92 Favored 'General case' 0 CA--C 1.515 -0.367 0 O-C-N 124.705 1.253 . . . . 35.13 108.615 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.54 ' HD2' ' OE1' ' A' ' 26' ' ' GLU . 15.3 mmm180 -61.27 -48.6 80.67 Favored 'General case' 0 C--O 1.19 -2.049 0 CA-C-N 115.143 -0.935 . . . . 72.51 112.574 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.5 mt -58.58 -47.01 85.73 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.468 0.576 . . . . 74.02 111.145 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.496 HG23 ' O ' ' A' ' 34' ' ' LEU . 89.3 mt -60.57 -36.24 68.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.488 -1.233 . . . . 74.12 110.285 -177.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -84.4 -53.66 5.3 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-O 121.069 0.461 . . . . 72.44 111.08 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -63.42 -35.29 79.92 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 116.036 1.865 . . . . 65.13 116.036 -173.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.49 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 5.7 mp -96.88 -6.72 35.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 118.515 -1.274 . . . . 65.25 111.021 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.6 t30 61.32 74.16 0.45 Allowed 'General case' 0 C--O 1.246 0.884 0 CA-C-O 122.522 1.153 . . . . 74.41 108.866 -172.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.496 ' O ' HG23 ' A' ' 29' ' ' ILE . 46.2 mt -120.46 130.57 54.36 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.33 -1.359 . . . . 73.31 107.33 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.404 ' OG1' ' HB2' ' A' ' 38' ' ' GLN . 32.4 p -79.33 163.55 58.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 108.697 -0.853 . . . . 74.13 108.697 176.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -63.27 -20.3 70.28 Favored 'Trans proline' 0 N--CA 1.485 0.984 0 C-N-CA 121.918 1.746 . . . . 71.45 112.213 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -84.47 -25.19 29.07 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.425 0.631 . . . . 73.54 109.493 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' HB2' ' OG1' ' A' ' 35' ' ' THR . 45.6 tt0 -85.47 -43.18 13.8 Favored 'General case' 0 N--CA 1.434 -1.258 0 N-CA-C 108.479 -0.934 . . . . 75.02 108.479 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.36 75.48 1.62 Allowed 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 108.718 -0.845 . . . . 71.43 108.718 177.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -94.38 165.23 12.67 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 107.0 -1.482 . . . . 75.44 107.0 171.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' CD ' HH12 ' A' ' 25' ' ' ARG . 6.3 mm-40 -53.18 -34.47 57.06 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 114.61 1.337 . . . . 72.22 114.61 -171.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.72 4.44 43.1 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.786 -0.571 . . . . 64.02 110.848 -174.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 26.2 t -66.29 136.5 55.92 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-O 121.397 0.617 . . . . 74.54 110.859 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 43.4 t-20 -83.13 101.11 10.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.376 -0.829 . . . . 63.23 109.14 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.504 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 31.5 mt -58.53 -28.5 65.52 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 114.786 1.402 . . . . 74.24 114.786 -176.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.2 mm -68.65 -34.82 67.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.175 -0.676 . . . . 60.11 109.175 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -82.87 -10.82 58.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.176 -0.92 . . . . 73.21 109.85 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.96 -4.2 58.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.232 -0.895 . . . . 44.3 108.763 175.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.09 44.37 2.83 Favored Glycine 0 N--CA 1.43 -1.749 0 CA-C-N 114.874 -1.057 . . . . 72.41 112.81 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -100.95 97.08 7.7 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.959 -0.756 . . . . 72.42 108.959 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -68.87 170.73 9.1 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.666 -1.152 . . . . 63.52 109.567 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 21.6 m -78.32 -14.59 59.35 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 115.224 1.565 . . . . 63.33 115.224 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.9 mm -80.64 -42.76 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 106.473 -1.677 . . . . 73.41 106.473 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.527 ' O ' ' HB2' ' A' ' 57' ' ' ARG . 25.5 ttm180 -63.82 -24.59 67.81 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 115.477 -0.783 . . . . 73.32 109.531 175.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.5 tp -78.42 -37.72 43.13 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.976 -0.556 . . . . 75.5 109.541 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.4 tpp -73.99 -29.03 61.75 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.063 -1.088 . . . . 74.33 108.063 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.527 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 7.0 mmm180 -53.45 -33.07 52.76 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 113.432 -1.713 . . . . 63.3 110.523 174.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.503 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 23.1 m95 -83.6 -32.71 25.59 Favored 'General case' 0 N--CA 1.42 -1.966 0 N-CA-C 113.441 0.904 . . . . 74.13 113.441 -178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.4 tp -59.2 -43.63 92.23 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.777 0.322 . . . . 71.11 111.035 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -76.37 -18.23 58.98 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.372 -0.531 . . . . 75.2 110.544 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.721 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 53.6 t90 -77.63 -37.32 50.37 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 109.22 -0.659 . . . . 71.3 109.22 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.657 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 88.2 m-85 -64.71 -53.86 40.65 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.886 -1.153 . . . . 75.13 107.886 172.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -12.84 3.66 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 115.808 1.781 . . . . 74.05 115.808 -175.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.721 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 32.2 mtmm -42.06 -51.45 4.53 Favored 'General case' 0 N--CA 1.528 3.438 0 C-N-CA 123.943 0.897 . . . . 71.05 112.099 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -114.12 19.69 16.22 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.014 -0.994 . . . . 55.43 109.675 -174.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 82.92 37.35 13.18 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 115.113 -0.949 . . . . 53.3 113.122 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.657 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 19.8 m-85 -75.31 164.61 26.25 Favored 'General case' 0 CA--C 1.476 -1.866 0 C-N-CA 119.704 -0.799 . . . . 74.51 109.308 172.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -132.58 107.27 8.33 Favored 'General case' 0 C--N 1.282 -2.336 0 C-N-CA 118.382 -1.327 . . . . 74.44 113.034 -162.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 62' ' ' PHE . 3.1 pp -167.88 153.56 7.21 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 124.424 1.077 . . . . 74.21 111.804 165.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 p -96.2 142.9 27.81 Favored 'General case' 0 N--CA 1.408 -2.565 0 N-CA-C 107.684 -1.228 . . . . 61.12 107.684 173.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.539 HD12 HD12 ' A' ' 74' ' ' LEU . 17.9 tp -71.5 -23.85 61.87 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.796 0.665 . . . . 65.31 112.796 -171.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.484 ' HB2' ' OE1' ' A' ' 73' ' ' GLU . 21.9 mtm180 -54.41 -30.34 52.07 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.816 0.817 . . . . 62.2 108.813 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.484 ' OE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 mm-40 -76.03 -24.76 55.22 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.046 -1.434 . . . . 73.13 109.963 -169.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.539 HD12 HD12 ' A' ' 71' ' ' LEU . 25.8 mt -81.47 -17.53 48.38 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.115 -0.948 . . . . 51.34 109.378 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -82.54 -40.37 21.06 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.829 -0.804 . . . . 74.24 108.829 172.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.86 -48.57 78.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.224 -0.898 . . . . 44.14 110.786 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.82 84.73 60.37 Favored Pre-proline 0 N--CA 1.435 -1.194 0 N-CA-C 109.414 -0.587 . . . . 73.11 109.414 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.475 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 18.3 Cg_endo -87.18 86.43 0.75 Allowed 'Trans proline' 0 N--CA 1.42 -2.84 0 C-N-CA 121.035 1.157 . . . . 71.41 111.925 -177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 p -152.34 144.02 23.54 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.13 -1.433 . . . . 73.24 107.13 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.557 HD11 ' HD3' ' A' ' 25' ' ' ARG . 2.4 tm? -51.73 -50.95 59.56 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 123.989 0.806 . . . . 63.1 110.538 -177.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.82 -40.09 59.88 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 124.074 0.859 . . . . 62.52 111.745 -179.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.599 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.0 -49.44 57.78 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.284 0.365 . . . . 24.32 111.32 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -58.16 -42.31 85.69 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.696 -0.853 . . . . 73.24 108.696 -179.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.17 -50.18 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.449 -1.25 . . . . 74.45 111.217 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.468 ' HG2' ' HA ' ' A' ' 82' ' ' ALA . 16.1 pt20 -68.89 -27.77 66.09 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-O 119.257 -0.401 . . . . 63.34 110.141 -178.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 77.0 mt -61.03 -34.98 75.7 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 112.712 0.634 . . . . 72.25 112.712 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.657 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 40.3 mtt -53.48 -37.49 62.75 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.403 0.621 . . . . 74.3 110.487 174.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.486 HD12 ' HD3' ' A' ' 16' ' ' ARG . 1.3 mm? -88.7 -41.93 12.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.585 -0.734 . . . . 74.52 112.684 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.8 m -69.79 -23.61 63.37 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 122.983 0.513 . . . . 73.55 112.153 -174.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 16.6 mmm180 -81.04 -58.91 2.86 Favored 'General case' 0 CA--C 1.494 -1.2 0 C-N-CA 120.166 -0.613 . . . . 74.44 109.436 177.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.472 ' HB2' ' HD3' ' A' ' 92' ' ' PRO 0.301 48.9 m 67.99 -83.61 0.0 OUTLIER Pre-proline 0 CA--C 1.589 2.468 0 CA-C-O 117.621 -1.181 . . . . 64.2 111.48 -169.455 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 91' ' ' SER . 47.8 Cg_endo -98.14 117.99 0.13 Allowed 'Trans proline' 0 C--N 1.386 2.527 0 CA-C-N 123.639 2.335 . . . . 74.32 112.452 168.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 . . . . . 0 N--CA 1.481 1.108 0 C-N-CA 125.343 1.457 . . . . 70.32 114.485 177.578 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 110.131 -0.322 . . . . 74.01 110.131 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -155.17 104.54 2.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 118.06 0.391 . . . . 74.35 110.177 173.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.611 ' HD3' ' C ' ' A' ' 93' ' ' GLU . 1.8 mpt_? -111.0 -67.56 0.99 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.031 0.919 . . . . 72.54 109.511 173.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.41 ' HB3' ' CE2' ' A' ' 67' ' ' TYR . 70.2 m80 -75.6 -33.35 60.54 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.331 -1.304 . . . . 72.01 111.772 -173.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -67.34 -14.33 62.82 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 114.445 -1.252 . . . . 70.21 113.902 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -53.54 -35.43 60.71 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 110.175 -0.306 . . . . 51.54 110.175 172.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -71.81 -39.22 69.97 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 107.987 -1.116 . . . . 74.21 107.987 176.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.552 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 86.0 t80 -56.79 -22.74 38.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.18 1.392 . . . . 74.43 112.252 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.35 -44.84 88.95 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 108.453 -0.943 . . . . 60.35 108.453 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.6 mm-40 -64.55 -29.29 70.32 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.48 -0.782 . . . . 71.22 111.554 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.52 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 8.3 tt -71.77 -32.26 67.48 Favored 'General case' 0 C--O 1.196 -1.721 0 C-N-CA 120.589 -0.444 . . . . 64.33 109.827 176.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' CD ' HD13 ' A' ' 80' ' ' LEU . 9.6 mmm180 -76.04 -49.1 18.46 Favored 'General case' 0 CA--C 1.483 -1.623 0 N-CA-C 108.231 -1.026 . . . . 74.24 108.231 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 27' ' ' ARG . 45.2 mt-10 -51.94 -46.73 64.84 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 124.474 1.109 . . . . 71.44 110.753 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -75.8 -46.8 28.64 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 113.264 0.839 . . . . 73.34 113.264 179.335 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -67.34 -36.15 80.84 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.122 0.874 . . . . 72.51 112.082 -176.979 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.535 HG12 HD13 ' A' ' 39' ' ' LEU . 97.1 mt -72.52 -24.62 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-O 121.732 0.777 . . . . 71.23 109.611 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -84.04 -36.0 23.41 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.607 -0.724 . . . . 65.35 109.352 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 8.0 tp10 -46.73 -54.29 10.0 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 127.649 2.38 . . . . 72.2 113.32 -176.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.538 HD11 HD23 ' A' ' 50' ' ' LEU . 94.1 mt -105.86 16.63 24.91 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.738 -0.785 . . . . 74.1 111.564 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 t30 56.65 58.36 4.18 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 123.008 1.385 . . . . 74.25 108.354 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.432 HD13 HD12 ' A' ' 39' ' ' LEU . 19.0 mt -102.8 168.5 9.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 113.771 -1.559 . . . . 35.32 109.042 -176.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.406 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 10.3 p -141.19 158.63 63.85 Favored Pre-proline 0 C--N 1.279 -2.478 0 N-CA-C 105.853 -1.906 . . . . 53.24 105.853 177.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.79 -19.95 41.15 Favored 'Trans proline' 0 CA--C 1.552 1.403 0 C-N-CA 122.46 2.107 . . . . 73.15 113.397 -178.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.406 ' OE1' ' HB ' ' A' ' 35' ' ' THR . 21.9 mp0 -74.26 -32.63 63.02 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.905 0.384 . . . . 54.45 111.136 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -98.65 -31.31 11.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.168 0.508 . . . . 73.34 110.713 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.535 HD13 HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -107.17 88.7 2.79 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.56 -1.274 . . . . 72.15 107.56 177.214 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -94.96 165.09 12.62 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 103.975 -2.602 . . . . 74.41 103.975 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.513 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 35.5 mm-40 -52.98 -42.04 65.17 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.665 0.745 . . . . 63.22 110.506 -178.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -80.79 0.19 35.91 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 125.891 1.676 . . . . 62.41 113.512 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.3 m -74.82 128.41 35.49 Favored 'General case' 0 C--O 1.247 0.957 0 C-N-CA 120.058 -0.657 . . . . 54.45 110.289 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.537 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 23.8 t-20 -73.4 114.16 11.3 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.868 -0.606 . . . . 71.2 110.198 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.6 mt -66.51 -24.38 66.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 114.335 1.235 . . . . 42.33 114.335 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.0 mm -74.97 -38.0 42.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.033 -0.728 . . . . 71.0 109.033 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -72.78 -25.12 61.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.41 -0.813 . . . . 55.22 110.286 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.94 -33.16 71.76 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.147 -0.686 . . . . 34.44 109.147 174.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.38 33.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.135 0 C-N-CA 120.28 -0.962 . . . . 50.03 115.184 174.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.538 HD23 HD11 ' A' ' 32' ' ' LEU . 40.9 mt -81.99 106.97 14.33 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 117.982 0.891 . . . . 41.43 109.663 174.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 163.78 19.11 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.72 -0.844 . . . . 73.02 108.72 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.9 p -72.24 -19.54 61.69 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 114.571 1.323 . . . . 74.23 114.571 -173.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.547 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 50.5 mm -76.61 -44.02 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.446 0 N-CA-C 106.906 -1.516 . . . . 63.53 106.906 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HD3' ' CD ' ' A' ' 31' ' ' GLU . 10.2 ttm180 -59.37 -39.14 82.33 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.261 -0.881 . . . . 73.3 108.884 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.56 -45.67 86.07 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 114.855 -1.066 . . . . 70.13 109.94 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 21.3 ptp -75.63 -18.58 59.64 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 121.95 -0.469 . . . . 61.4 111.173 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 36.4 mtm180 -63.14 -42.59 99.5 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.411 -1.329 . . . . 73.23 107.411 173.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 51.7 m95 -62.81 -35.98 81.69 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 114.474 -1.239 . . . . 72.11 112.485 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.406 HD22 ' HB2' ' A' ' 71' ' ' LEU . 61.9 tp -55.08 -40.83 70.81 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.331 0.586 . . . . 72.23 110.533 177.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -73.74 -32.09 63.68 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.536 -0.757 . . . . 71.3 110.848 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.611 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 62.6 t90 -66.41 -46.05 77.87 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.705 -0.68 . . . . 70.23 109.593 176.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -61.54 -47.97 83.13 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 122.202 1.001 . . . . 73.14 110.249 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -66.63 -12.16 56.86 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 114.476 -1.238 . . . . 71.22 113.62 -172.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.611 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 31.0 mtmm -49.67 -50.86 41.78 Favored 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 121.672 0.749 . . . . 61.52 109.859 177.126 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -102.96 21.73 15.16 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-N 114.855 -1.066 . . . . 71.35 108.158 -176.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.19 47.15 92.49 Favored Glycine 0 N--CA 1.426 -1.987 0 CA-C-N 114.069 -1.423 . . . . 52.24 112.04 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 17' ' ' HIS 0.426 35.3 m-85 -61.94 151.54 34.6 Favored 'General case' 0 CA--C 1.48 -1.744 0 N-CA-C 113.895 1.072 . . . . 72.33 113.895 178.918 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -88.67 66.06 7.97 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-N 113.731 -1.577 . . . . 75.13 112.927 -159.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -160.65 178.04 9.88 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.751 0.786 . . . . 72.34 112.82 179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.4 m -133.7 167.75 19.96 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.359 -2.46 . . . . 71.44 104.359 177.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.406 ' HB2' HD22 ' A' ' 59' ' ' LEU . 25.6 tp -64.3 -27.42 69.02 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 119.0 0.818 . . . . 74.33 111.236 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -55.11 -34.37 63.64 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.921 -0.77 . . . . 54.0 108.921 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -71.34 -33.07 69.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.067 -1.424 . . . . 73.44 110.013 -169.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.6 mt -78.49 -22.6 47.24 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 114.58 -1.191 . . . . 42.42 110.135 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -82.29 -39.69 22.57 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.463 -0.569 . . . . 75.44 109.463 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.94 -47.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.343 -0.844 . . . . 74.55 111.229 -178.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.01 81.58 57.16 Favored Pre-proline 0 N--CA 1.434 -1.256 0 C-N-CA 120.426 -0.51 . . . . 62.33 110.884 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.537 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 7.9 Cg_endo -87.62 87.0 0.65 Allowed 'Trans proline' 0 N--CA 1.427 -2.413 0 C-N-CA 121.53 1.487 . . . . 71.22 111.302 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.0 p -155.02 141.55 18.81 Favored 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 104.859 -2.275 . . . . 73.34 104.859 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.562 HD13 ' CD ' ' A' ' 25' ' ' ARG . 12.2 mt -61.37 -27.41 68.5 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 118.703 -1.199 . . . . 73.52 112.717 -178.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.513 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -54.55 -46.89 73.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 123.801 0.688 . . . . 64.25 110.291 176.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.625 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.82 -46.33 65.88 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.569 -0.741 . . . . 45.44 110.683 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.41 ' HE1' ' HA ' ' A' ' 78' ' ' PRO . 10.9 m0 -53.89 -35.36 61.51 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.163 0.585 . . . . 75.03 111.807 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.501 ' HB2' ' CZ ' ' A' ' 21' ' ' TYR . 33.0 t30 -75.89 -48.73 20.21 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.271 0.558 . . . . 71.4 110.834 178.011 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -67.46 -23.0 65.46 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.89 -0.595 . . . . 73.33 112.273 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.625 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 77.4 mt -61.98 -24.48 67.05 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 122.104 -0.372 . . . . 63.05 111.392 176.612 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.8 mtt -84.5 -63.08 1.4 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.134 0.492 . . . . 73.43 110.788 174.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.728 ' HG ' ' OXT' ' A' ' 93' ' ' GLU . 7.6 mp -69.6 -16.08 63.32 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 115.93 1.826 . . . . 55.01 115.93 -175.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.6 m -108.88 9.29 26.71 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.133 -0.979 . . . . 72.21 111.338 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -126.91 4.4 6.58 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.656 0.741 . . . . 73.42 110.364 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.473 ' HB3' ' HD2' ' A' ' 92' ' ' PRO . 74.3 m -162.93 179.33 1.27 Allowed Pre-proline 0 C--N 1.304 -1.377 0 N-CA-C 104.983 -2.229 . . . . 72.24 104.983 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' A' ' 91' ' ' SER . 49.6 Cg_exo -42.65 148.94 0.39 Allowed 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.096 1.864 . . . . 73.25 112.585 172.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.728 ' OXT' ' HG ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.425 0 N-CA-C 113.845 1.054 . . . . 61.11 113.845 -171.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 CA--C 1.537 0.478 0 CA-C-O 119.704 -0.189 . . . . 75.22 111.243 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.76 119.24 6.91 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 121.299 0.571 . . . . 61.52 111.43 178.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.562 ' H ' HD11 ' A' ' 88' ' ' LEU . 2.9 mpt_? -111.85 -75.75 0.61 Allowed 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.119 -1.067 . . . . 61.12 108.119 171.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.484 ' HB3' ' CE2' ' A' ' 67' ' ' TYR . 8.2 m-70 -78.01 -21.53 50.65 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.815 0.817 . . . . 62.24 110.461 174.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.537 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -60.81 -14.84 24.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 113.809 -1.541 . . . . 75.41 112.715 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.26 -29.86 10.54 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-O 121.195 0.522 . . . . 75.03 110.263 172.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -68.3 -44.79 74.69 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.652 -0.704 . . . . 74.13 109.371 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.507 ' CE2' HD22 ' A' ' 24' ' ' LEU . 68.4 t80 -64.27 -23.85 67.45 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.363 0.665 . . . . 62.23 110.736 178.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -60.01 -32.48 70.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.403 -0.592 . . . . 55.21 109.403 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.446 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 29.6 mm-40 -72.47 -43.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.886 -0.597 . . . . 74.21 110.312 176.065 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.507 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.3 tt -59.44 -37.24 77.6 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.907 -0.405 . . . . 65.24 109.907 177.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HD2' HD13 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -58.54 -48.17 81.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 75.34 109.805 -179.624 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -43.93 95.88 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 115.42 -0.809 . . . . 74.31 110.922 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -62.78 -34.52 77.41 Favored 'General case' 0 C--O 1.213 -0.86 0 C-N-CA 119.567 -0.853 . . . . 64.25 111.474 177.391 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.524 ' O ' HD12 ' A' ' 34' ' ' LEU . 15.2 mt -63.41 -30.69 71.77 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.778 0.659 . . . . 73.0 112.778 176.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.473 ' CD1' HD12 ' A' ' 39' ' ' LEU . 17.3 mm -60.83 -40.09 84.02 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 108.439 -0.949 . . . . 60.21 108.439 176.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -79.33 -44.6 21.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.056 -0.52 . . . . 73.14 110.378 -178.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -44.86 -54.48 6.37 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.289 1.835 . . . . 74.14 114.996 -170.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.482 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 90.3 mt -106.49 20.28 19.22 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.702 -0.799 . . . . 72.3 111.266 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t30 59.13 53.0 5.72 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 123.204 1.478 . . . . 72.12 107.787 -175.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.524 HD12 ' O ' ' A' ' 28' ' ' LEU . 64.4 mt -95.46 -176.9 3.91 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 113.963 -1.471 . . . . 74.15 108.486 -178.02 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -152.97 148.91 20.83 Favored Pre-proline 0 C--N 1.276 -2.595 0 N-CA-C 103.469 -2.789 . . . . 74.34 103.469 -177.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -51.06 -35.13 49.88 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.867 1.711 . . . . 73.22 112.931 179.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -0.8 29.76 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.141 0.496 . . . . 75.42 111.388 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -119.9 -15.31 8.84 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.541 -0.911 . . . . 64.23 108.541 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.506 HD13 HD11 ' A' ' 80' ' ' LEU . 2.5 tm? -129.02 81.31 2.02 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 122.414 1.102 . . . . 64.55 109.235 -173.253 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -96.75 166.77 11.49 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.166 -2.288 . . . . 74.5 107.884 178.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.434 ' CD ' HH21 ' A' ' 25' ' ' ARG . 10.9 mm-40 -62.78 -26.51 68.75 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.353 -1.351 . . . . 53.11 107.353 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.29 -10.55 59.84 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.799 2.039 . . . . 74.31 111.453 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.7 m -79.24 120.04 23.17 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.276 0.56 . . . . 72.22 111.784 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.565 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 44.1 t-20 -69.83 112.63 6.4 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.445 -0.946 . . . . 70.53 108.445 175.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.43 HD11 HD23 ' A' ' 80' ' ' LEU . 51.2 mt -68.4 -30.63 69.58 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 114.089 1.144 . . . . 70.3 114.089 -176.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.5 mm -71.21 -35.28 57.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 108.342 -0.984 . . . . 72.52 108.342 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -72.24 -26.3 61.96 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.719 -1.128 . . . . 70.44 109.581 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.95 -11.56 59.82 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.615 -0.72 . . . . 70.03 110.132 177.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.38 31.58 10.41 Favored Glycine 0 N--CA 1.429 -1.788 0 CA-C-N 115.668 -0.696 . . . . 41.34 113.135 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.9 tp -75.88 101.36 5.12 Favored 'General case' 0 N--CA 1.421 -1.883 0 N-CA-C 107.493 -1.299 . . . . 64.52 107.493 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 3.3 p30 -61.15 162.69 7.04 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.566 0.698 . . . . 74.45 110.187 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.415 ' O ' ' HG2' ' A' ' 56' ' ' MET . 20.0 m -74.34 -14.81 60.93 Favored 'General case' 0 N--CA 1.414 -2.231 0 N-CA-C 114.071 1.137 . . . . 71.41 114.071 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.679 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 48.1 mm -76.98 -44.38 31.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.37 0 N-CA-C 106.521 -1.659 . . . . 73.23 106.521 175.061 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -50.12 -49.16 52.69 Favored 'General case' 0 CA--C 1.503 -0.84 0 N-CA-C 108.692 -0.855 . . . . 72.01 108.692 175.104 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tp -58.8 -52.88 63.84 Favored 'General case' 0 CA--C 1.553 1.081 0 O-C-N 125.564 1.79 . . . . 54.03 111.151 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 52' ' ' SER . 21.6 ptp -77.07 -18.75 57.82 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.826 1.047 . . . . 74.54 113.826 -177.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.679 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.5 mtm180 -61.37 -43.26 99.17 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.528 -1.286 . . . . 75.43 107.528 174.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.417 ' O ' ' HD1' ' A' ' 62' ' ' PHE . 18.2 m95 -64.53 -32.02 73.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.948 -1.478 . . . . 75.25 111.023 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.465 ' HB2' HD13 ' A' ' 71' ' ' LEU . 3.4 tm? -57.22 -35.62 69.89 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.597 0.759 . . . . 54.41 109.308 178.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 -81.63 -41.71 21.06 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.233 -0.439 . . . . 74.03 109.824 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.595 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 81.6 t90 -51.96 -42.88 63.23 Favored 'General case' 0 C--O 1.211 -0.973 0 C-N-CA 124.599 1.16 . . . . 72.12 112.587 -177.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 18.9 m-85 -63.96 -52.42 59.78 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-O 122.118 0.961 . . . . 71.23 112.642 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -63.02 -13.44 35.51 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 116.442 2.016 . . . . 75.2 116.442 -166.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.595 ' HD2' ' O ' ' A' ' 61' ' ' TRP . 0.0 OUTLIER -62.14 -22.98 66.29 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.895 0.771 . . . . 65.32 111.693 -178.916 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -113.81 24.26 12.27 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 122.562 1.172 . . . . 63.12 108.322 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.39 42.52 89.62 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 114.635 -1.166 . . . . 64.41 112.563 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.484 ' CE2' ' HB3' ' A' ' 17' ' ' HIS . 21.8 m-85 -87.56 168.08 13.37 Favored 'General case' 0 CA--C 1.487 -1.475 0 C-N-CA 120.304 -0.558 . . . . 75.34 112.458 178.209 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.6 ttt180 -116.14 120.07 37.85 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.882 -1.054 . . . . 62.42 111.869 -170.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.406 HD12 HD11 ' A' ' 74' ' ' LEU . 1.4 pt? -168.76 138.91 2.36 Favored 'General case' 0 CA--C 1.483 -1.596 0 O-C-N 124.439 1.087 . . . . 71.1 111.035 161.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 72.0 p -103.94 142.63 34.09 Favored 'General case' 0 N--CA 1.396 -3.154 0 N-CA-C 103.464 -2.791 . . . . 72.33 103.464 165.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 59' ' ' LEU . 13.3 tp -68.04 -23.93 65.03 Favored 'General case' 0 C--N 1.292 -1.911 0 C-N-CA 119.738 -0.785 . . . . 74.0 111.933 -171.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.674 ' O ' ' HD3' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.97 -21.85 66.67 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.774 -0.824 . . . . 73.23 108.774 -179.986 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.54 -34.94 65.44 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 121.541 0.686 . . . . 72.34 109.282 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.542 HD22 ' CD1' ' A' ' 83' ' ' TRP . 12.6 mt -73.25 -29.95 63.12 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.266 -0.879 . . . . 73.43 109.523 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -84.34 4.43 31.26 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.595 -0.73 . . . . 74.45 110.49 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.73 -53.14 3.38 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.613 -0.884 . . . . 61.54 108.613 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.42 88.36 54.29 Favored Pre-proline 0 N--CA 1.43 -1.455 0 N-CA-C 107.863 -1.162 . . . . 71.22 107.863 175.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.565 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 18.5 Cg_endo -82.59 86.81 1.45 Allowed 'Trans proline' 0 N--CA 1.427 -2.384 0 C-N-CA 121.018 1.145 . . . . 72.13 112.494 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' A' ' 41' ' ' GLU . 3.1 p -154.6 156.79 37.18 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 105.266 -2.124 . . . . 61.42 105.266 178.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.584 HD13 ' HD2' ' A' ' 25' ' ' ARG . 57.3 mt -57.08 -45.11 83.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.561 0.696 . . . . 64.12 110.955 -179.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.416 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -44.83 -44.93 9.86 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 113.433 -1.712 . . . . 65.35 113.129 -176.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.714 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -62.07 -48.6 79.49 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 123.073 0.233 . . . . 63.44 111.528 -178.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.542 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -68.87 -34.08 74.84 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 107.916 -1.142 . . . . 73.0 107.916 -174.078 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -60.85 -50.2 74.41 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.624 -1.171 . . . . 74.5 109.125 177.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.43 -17.49 63.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.622 -0.717 . . . . 72.22 112.085 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 71.7 mt -68.41 -20.28 64.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.392 0.615 . . . . 72.25 110.692 176.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.537 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 57.3 mtt -81.93 -39.24 24.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 120.514 -0.474 . . . . 64.05 110.235 173.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.562 HD11 ' H ' ' A' ' 16' ' ' ARG . 2.9 mm? -73.46 -27.2 61.28 Favored 'General case' 0 C--O 1.194 -1.83 0 N-CA-C 112.677 0.621 . . . . 73.1 112.677 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.7 p -81.23 12.52 3.46 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.77 0.795 . . . . 71.54 111.155 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.41 -0.68 6.28 Favored 'General case' 0 N--CA 1.401 -2.915 0 C-N-CA 126.069 1.748 . . . . 72.21 108.593 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.9 m -140.69 -179.84 1.09 Allowed Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.147 -0.686 . . . . 65.31 109.147 -173.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -79.56 156.15 24.73 Favored 'Trans proline' 0 C--O 1.252 1.19 0 C-N-CA 121.398 1.399 . . . . 63.21 110.441 170.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 C--N 1.305 -1.337 0 N-CA-C 107.139 -1.43 . . . . 75.13 107.139 -179.999 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 . . . . . 0 CA--C 1.514 -0.424 0 N-CA-C 106.486 -1.672 . . . . 72.25 106.486 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -144.59 28.66 1.29 Allowed 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.378 0.423 . . . . 71.42 109.875 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.56 ' HD2' ' N ' ' A' ' 17' ' ' HIS 0.285 0.0 OUTLIER -55.56 -34.84 65.11 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.285 1.587 . . . . 71.31 115.285 -172.685 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.56 ' N ' ' HD2' ' A' ' 16' ' ' ARG . 67.3 m170 -78.51 -42.57 29.21 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.516 1.151 . . . . 62.44 109.726 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -67.76 -15.37 63.6 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 114.062 -1.426 . . . . 72.34 113.526 -173.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.31 -30.09 66.4 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.577 -0.283 . . . . 73.2 111.234 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -82.68 -27.03 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.525 0.678 . . . . 62.05 109.597 176.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.517 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 84.7 t80 -58.83 -26.75 64.45 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.752 -0.658 . . . . 54.04 109.648 174.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -58.84 -34.61 71.76 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.345 -0.843 . . . . 52.11 109.815 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -66.01 -36.87 84.45 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.484 0.659 . . . . 74.54 109.747 177.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.49 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.7 tt -67.33 -33.58 75.55 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 115.451 -0.795 . . . . 63.11 109.296 175.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -78.86 -44.3 23.19 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.443 -0.798 . . . . 65.12 112.014 -172.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.84 -44.26 81.93 Favored 'General case' 0 N--CA 1.427 -1.624 0 O-C-N 124.074 0.859 . . . . 62.12 109.944 174.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.516 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 33.5 mtp180 -64.19 -42.95 96.45 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 120.305 -0.558 . . . . 70.13 111.435 174.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 24' ' ' LEU . 1.3 tt -51.64 -38.16 53.53 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.165 0.986 . . . . 63.04 111.144 -177.277 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.1 mt -66.99 -36.55 77.41 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.986 -0.552 . . . . 74.23 111.785 178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -80.68 -33.27 35.58 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.67 -0.644 . . . . 74.02 111.299 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 79.9 mm-40 -48.26 -53.51 16.9 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.036 0.934 . . . . 65.52 113.397 -177.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.554 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 81.6 mt -102.6 13.55 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.237 -0.985 . . . . 73.31 111.457 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.9 t30 57.4 44.51 21.44 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.706 1.241 . . . . 74.22 109.339 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.554 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 38.8 mt -79.75 131.07 35.83 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 114.379 -1.282 . . . . 75.33 110.86 -174.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -79.78 145.87 63.21 Favored Pre-proline 0 C--N 1.287 -2.129 0 N-CA-C 106.541 -1.651 . . . . 64.2 106.541 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.09 -29.08 81.85 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 C-N-CA 122.037 1.825 . . . . 52.43 112.556 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -77.91 -13.17 59.97 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.138 0.494 . . . . 75.21 110.682 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.451 ' OE1' ' HA ' ' A' ' 34' ' ' LEU . 65.6 tt0 -95.66 -46.59 6.55 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 108.251 -1.018 . . . . 65.04 108.251 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.409 HD23 ' HB3' ' A' ' 43' ' ' SER . 0.3 OUTLIER -97.05 76.47 2.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 108.845 -0.798 . . . . 63.42 108.845 178.979 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -76.22 165.37 24.98 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 106.908 -1.515 . . . . 72.41 106.908 169.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.75 -51.75 5.23 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.923 1.083 . . . . 74.4 113.923 -172.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -105.13 26.09 9.75 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 113.532 0.938 . . . . 64.4 113.532 -178.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB3' HD23 ' A' ' 39' ' ' LEU . 22.2 t -59.63 134.38 56.97 Favored 'General case' 0 C--O 1.245 0.862 0 N-CA-C 108.631 -0.877 . . . . 74.23 108.631 175.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.471 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 6.2 m-20 -73.01 99.14 2.66 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.998 -0.546 . . . . 75.13 110.835 -177.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.5 mt -55.45 -38.81 69.53 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.71 1.004 . . . . 74.34 113.71 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.428 HG12 ' CB ' ' A' ' 78' ' ' PRO . 45.9 mm -63.83 -35.14 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-O 121.055 0.455 . . . . 72.52 110.361 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -85.84 -10.86 54.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.215 0.531 . . . . 73.02 110.385 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -86.91 -12.39 47.84 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.829 -0.804 . . . . 64.23 108.829 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.48 22.96 7.47 Favored Glycine 0 N--CA 1.436 -1.348 0 CA-C-N 115.239 -0.891 . . . . 73.14 114.436 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.83 99.65 1.41 Allowed 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.704 -1.221 . . . . 74.0 107.704 176.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -64.47 153.24 39.45 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.557 -1.201 . . . . 71.52 108.833 178.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.419 ' O ' ' HG2' ' A' ' 56' ' ' MET . 37.5 m -72.26 -14.45 61.77 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 113.914 1.079 . . . . 62.22 113.914 -175.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.595 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 50.8 mm -75.29 -47.35 35.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 118.421 -1.312 . . . . 75.31 107.847 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.428 ' NE ' ' HB3' ' A' ' 31' ' ' GLU . 32.7 ttm105 -63.9 -35.93 82.27 Favored 'General case' 0 N--CA 1.438 -1.045 0 O-C-N 123.574 0.546 . . . . 75.13 109.619 178.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.448 ' HG ' HD11 ' A' ' 71' ' ' LEU . 14.8 tp -56.7 -49.86 73.88 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.03 -0.986 . . . . 52.34 109.064 176.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 52' ' ' SER . 19.5 ptp -80.73 -18.23 48.45 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.444 -0.502 . . . . 72.45 111.803 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 6.4 mmp_? -62.14 -40.13 94.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 107.921 -1.14 . . . . 74.34 107.921 176.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -63.43 -37.05 85.8 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.565 -1.198 . . . . 73.52 111.59 177.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.81 -34.77 73.49 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.674 0.75 . . . . 74.52 109.781 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.631 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 45.7 m80 -72.14 -34.32 68.43 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.096 -0.956 . . . . 74.34 110.175 177.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 t90 -66.66 -58.55 4.89 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 124.594 1.183 . . . . 75.45 109.953 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.429 ' CZ ' HD21 ' A' ' 69' ' ' LEU . 53.8 m-85 -44.89 -55.23 5.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.746 0.818 . . . . 63.11 112.273 -177.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.315 86.1 mtt-85 -71.22 -12.67 61.59 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 115.203 1.557 . . . . 62.52 115.203 -173.118 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 44.1 mmtm -82.44 -35.38 27.6 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.871 -0.788 . . . . 74.23 108.871 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -80.77 -9.32 59.82 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.895 -1.048 . . . . 70.13 110.422 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.73 -3.24 52.88 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.841 -0.618 . . . . 45.12 112.567 177.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -83.01 160.86 21.89 Favored 'General case' 0 CA--C 1.483 -1.634 0 CA-C-O 121.048 0.451 . . . . 73.34 110.963 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.468 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 53.9 mtt180 -145.05 131.64 19.87 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.822 -0.751 . . . . 71.12 112.575 -167.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.429 HD21 ' CZ ' ' A' ' 62' ' ' PHE . 3.1 pp -168.8 172.78 7.59 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 125.421 1.488 . . . . 75.05 107.193 170.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.0 p -116.54 149.84 38.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.974 -1.491 . . . . 74.11 106.974 171.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.591 HD12 HD12 ' A' ' 74' ' ' LEU . 10.9 tp -66.42 -24.0 66.39 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 112.054 0.39 . . . . 75.45 112.054 -173.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 55.5 mtm180 -52.18 -32.46 36.21 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.885 0.85 . . . . 73.1 109.479 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -78.92 -27.69 43.78 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.092 -1.413 . . . . 75.0 110.182 -173.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.591 HD12 HD12 ' A' ' 71' ' ' LEU . 17.0 mt -82.47 -17.79 44.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.289 -0.869 . . . . 74.41 110.158 -178.418 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -82.72 -35.92 26.28 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.86 -0.609 . . . . 74.14 109.447 173.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -42.2 85.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.532 -0.758 . . . . 64.15 110.626 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.38 90.75 23.93 Favored Pre-proline 0 N--CA 1.434 -1.253 0 N-CA-C 109.117 -0.697 . . . . 41.01 109.117 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.471 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 36.7 Cg_endo -93.63 85.82 0.16 Allowed 'Trans proline' 0 N--CA 1.422 -2.691 0 C-N-CA 121.035 1.157 . . . . 72.23 112.184 -179.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 38.9 p -147.49 174.03 12.1 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 104.859 -2.274 . . . . 73.23 104.859 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.5 mt -76.77 -44.07 34.39 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 120.431 1.469 . . . . 72.34 112.366 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 85' ' ' GLN . . . -60.73 -31.47 70.78 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.868 -0.605 . . . . 43.45 112.356 -173.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -59.41 -55.42 34.93 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.318 0.386 . . . . 64.41 110.99 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.453 ' CD1' HD22 ' A' ' 74' ' ' LEU . 1.0 OUTLIER -63.5 -39.18 93.77 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.681 -1.229 . . . . 73.02 107.681 -176.455 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -57.88 -50.37 73.54 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.6 -1.636 . . . . 71.11 110.694 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 81' ' ' ALA . 78.2 mt-30 -75.5 -32.12 60.42 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 116.156 -0.474 . . . . 74.41 111.295 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 92.6 mt -57.08 -32.25 66.07 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.348 0.499 . . . . 62.01 112.348 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.517 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 43.5 mtt -57.5 -52.08 66.86 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.468 0.651 . . . . 71.13 110.328 173.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -71.98 -36.28 69.74 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.873 0.694 . . . . 75.34 112.873 178.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.3 m -63.94 -22.29 66.86 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.611 0.569 . . . . 71.53 111.585 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.509 ' O ' ' HD2' ' A' ' 92' ' ' PRO . 54.4 mmt-85 -79.1 -74.89 0.26 Allowed 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 120.515 -0.474 . . . . 65.53 111.179 174.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . 0.303 45.6 m 62.03 -90.11 0.0 OUTLIER Pre-proline 0 CA--C 1.593 2.601 0 CA-C-O 117.461 -1.257 . . . . 64.52 111.002 -168.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 88.7 Cg_endo -87.28 153.85 8.05 Favored 'Trans proline' 0 C--N 1.388 2.642 0 CA-C-N 123.494 2.284 . . . . 60.12 111.507 170.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.468 ' OE1' ' HD3' ' A' ' 68' ' ' ARG . 21.2 tt0 . . . . . 0 N--CA 1.431 -1.378 0 N-CA-C 100.933 -3.729 . . . . 64.2 100.933 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.411 ' HB3' HD21 ' A' ' 84' ' ' ASN . 11.3 t70 . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 105.911 -1.885 . . . . 63.21 105.911 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.457 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 15.2 m120 88.98 100.62 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 126.301 1.841 . . . . 72.25 114.097 173.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.351 0.0 OUTLIER -110.47 -76.19 0.61 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 119.532 -0.867 . . . . 74.21 113.148 171.905 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -79.02 -31.52 44.7 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 103.973 -2.603 . . . . 75.12 103.973 168.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.457 ' HB3' ' HA ' ' A' ' 15' ' ' ASN . . . -50.61 -14.25 0.18 Allowed 'General case' 0 C--O 1.204 -1.335 0 CA-C-N 112.166 -2.288 . . . . 74.43 112.242 170.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -48.11 -21.96 0.56 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.487 0.715 . . . . 74.21 112.19 174.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.551 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 29.8 t70 -60.53 -30.17 69.58 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 122.336 1.065 . . . . 51.51 109.856 172.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.62 ' CE2' HD22 ' A' ' 24' ' ' LEU . 67.3 t80 -70.21 -21.54 63.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.53 -0.759 . . . . 64.42 110.004 177.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.445 ' HB2' ' O ' ' A' ' 19' ' ' ALA . 14.7 mm100 -68.19 -30.06 69.06 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.233 -0.655 . . . . 74.22 109.233 174.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.551 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 0.3 OUTLIER -69.1 -36.37 77.48 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.07 -1.085 . . . . 74.34 108.07 174.148 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.62 HD22 ' CE2' ' A' ' 21' ' ' TYR . 6.9 tt -68.32 -37.06 80.22 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.583 -0.735 . . . . 64.24 109.561 172.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HE ' ' HG ' ' A' ' 80' ' ' LEU . 1.8 mpt_? -54.12 -49.08 70.0 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.761 0.424 . . . . 71.22 111.216 176.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -50.71 -60.85 2.63 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.814 1.321 . . . . 75.11 108.69 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -69.72 -28.13 65.56 Favored 'General case' 0 N--CA 1.417 -2.08 0 N-CA-C 113.17 0.804 . . . . 73.13 113.17 -177.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -42.39 95.77 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 121.092 -1.005 . . . . 73.43 109.406 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.8 -42.04 82.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.293 -0.867 . . . . 62.21 109.312 177.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.01 -52.33 65.96 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 124.718 1.207 . . . . 63.12 111.09 178.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -69.25 -29.01 66.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.665 0.987 . . . . 74.34 113.665 -170.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.402 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 16.8 mt -97.45 3.13 50.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 118.955 -1.098 . . . . 64.02 112.944 170.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.99 45.88 14.3 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.911 1.339 . . . . 60.12 108.229 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.402 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 57.3 mt -88.34 -176.36 5.33 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.331 -1.304 . . . . 63.52 109.066 -179.14 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.5 m -140.43 148.27 52.99 Favored Pre-proline 0 C--N 1.28 -2.426 0 N-CA-C 105.537 -2.023 . . . . 52.15 105.537 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -55.66 -28.47 66.04 Favored 'Trans proline' 0 N--CA 1.491 1.328 0 C-N-CA 122.196 1.931 . . . . 74.33 112.371 177.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -76.61 -10.85 59.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.212 -0.449 . . . . 72.2 111.117 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -102.46 -23.39 13.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.087 -0.708 . . . . 70.2 109.087 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.6 tp -138.7 98.72 3.63 Favored 'General case' 0 N--CA 1.418 -2.05 0 C-N-CA 119.994 -0.682 . . . . 71.13 112.73 -172.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.415 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 28.3 t-80 -106.8 166.38 10.63 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 105.027 -2.212 . . . . 72.05 105.027 169.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.625 ' HA ' ' HB3' ' A' ' 80' ' ' LEU 0.508 17.0 pt-20 -64.5 -13.7 53.54 Favored 'General case' 0 CA--C 1.555 1.154 0 N-CA-C 117.518 2.414 . . . . 74.45 117.518 -171.713 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.415 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -91.62 -6.11 52.77 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 120.807 -1.183 . . . . 61.14 109.661 -179.518 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -75.48 141.17 43.14 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-N 115.618 -0.719 . . . . 25.32 111.975 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 3.7 m-20 -77.11 118.92 20.13 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.262 -0.881 . . . . 52.51 112.577 -178.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.446 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 25.6 mt -79.07 -33.97 44.1 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 114.704 1.372 . . . . 52.25 114.704 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.1 mm -69.27 -26.5 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-O 121.779 0.8 . . . . 44.31 109.477 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -85.16 -10.85 56.23 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.175 -0.92 . . . . 53.32 110.122 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -86.39 -19.74 29.27 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.747 -0.834 . . . . 72.21 108.747 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.57 29.7 3.3 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 115.432 -0.804 . . . . 33.15 115.053 174.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.446 ' CD1' ' HB3' ' A' ' 45' ' ' LEU . 72.8 mt -73.35 108.43 6.22 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 117.694 0.747 . . . . 73.34 110.482 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -67.8 163.47 21.69 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.751 -1.203 . . . . 64.14 107.751 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -72.8 -14.61 61.56 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 115.875 1.805 . . . . 73.21 115.875 -173.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.3 mm -86.24 -36.78 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 C-N-CA 117.991 -1.484 . . . . 62.32 107.746 176.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' HE ' ' HB2' ' A' ' 54' ' ' ARG . 7.7 ttm180 -65.34 -29.26 69.97 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 107.899 -1.148 . . . . 75.13 107.899 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.745 ' HG ' HD11 ' A' ' 71' ' ' LEU . 14.7 tp -73.96 -52.74 11.88 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.291 -1.322 . . . . 74.4 108.76 176.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.5 ttm -72.55 -22.62 60.98 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 113.13 0.789 . . . . 74.21 113.13 -174.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -64.83 -28.79 69.8 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.664 -0.814 . . . . 71.05 109.486 176.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.573 ' CZ3' ' HG ' ' A' ' 24' ' ' LEU . 16.8 m95 -71.06 -33.71 70.52 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.702 -0.681 . . . . 74.11 111.434 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.03 -37.55 74.57 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.501 0.667 . . . . 74.02 110.323 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -70.86 -44.27 66.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.942 -1.026 . . . . 73.41 109.808 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.53 ' CZ2' ' HB2' ' A' ' 24' ' ' LEU . 51.8 t90 -54.24 -53.69 50.13 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.588 1.155 . . . . 75.12 109.666 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.429 ' CD2' HD21 ' A' ' 69' ' ' LEU . 43.7 m-85 -54.17 -50.19 67.58 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.603 0.716 . . . . 74.25 112.275 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -77.32 -13.44 59.93 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 115.584 -0.735 . . . . 64.41 112.465 -174.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.762 ' NZ ' ' HA ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -83.31 -41.06 18.7 Favored 'General case' 0 C--N 1.312 -1.055 0 O-C-N 121.729 -0.607 . . . . 71.24 111.891 171.241 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -78.21 -11.2 59.91 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.032 0.833 . . . . 63.54 112.427 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.04 40.19 3.84 Favored Glycine 0 C--O 1.245 0.811 0 C-N-CA 120.385 -0.912 . . . . 50.25 112.739 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -114.47 167.13 10.99 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 122.488 -0.419 . . . . 75.22 111.884 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 53.7 ttt180 -128.91 94.19 3.78 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.447 0.536 . . . . 71.12 112.447 -166.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.429 HD21 ' CD2' ' A' ' 62' ' ' PHE . 1.4 pt? -167.74 161.83 13.55 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 109.715 -0.476 . . . . 64.43 109.715 175.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.746 ' HB ' ' OE2' ' A' ' 73' ' ' GLU . 2.6 m -116.6 165.19 13.54 Favored 'General case' 0 N--CA 1.417 -2.118 0 N-CA-C 107.082 -1.451 . . . . 70.1 107.082 174.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.745 HD11 ' HG ' ' A' ' 55' ' ' LEU . 14.8 tp -79.89 -23.91 41.54 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 112.287 0.477 . . . . 72.11 112.287 -174.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -67.98 -25.32 65.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 64.15 110.681 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.746 ' OE2' ' HB ' ' A' ' 70' ' ' THR . 2.2 mp0 -75.54 -34.98 60.79 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.597 -1.183 . . . . 73.25 108.668 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.724 HD12 HD12 ' A' ' 71' ' ' LEU . 56.8 mt -68.94 -17.44 63.95 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 113.018 -1.901 . . . . 75.11 112.133 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -81.79 -41.44 21.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.502 -0.555 . . . . 54.22 109.502 173.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.4 -43.72 80.63 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.315 -0.857 . . . . 63.34 110.653 -176.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -123.82 84.99 53.93 Favored Pre-proline 0 N--CA 1.428 -1.527 0 N-CA-C 107.947 -1.131 . . . . 71.42 107.947 175.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 58.0 Cg_endo -90.98 85.4 0.33 Allowed 'Trans proline' 0 N--CA 1.415 -3.139 0 C-N-CA 120.601 0.868 . . . . 63.12 112.338 -175.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 p -141.41 145.92 35.93 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.155 -0.929 . . . . 62.02 108.644 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.625 ' HB3' ' HA ' ' A' ' 41' ' ' GLU . 45.5 tp -60.3 -25.08 65.48 Favored 'General case' 0 C--N 1.279 -2.489 0 O-C-N 123.973 0.796 . . . . 61.22 112.007 -178.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.44 -37.88 50.65 Favored 'General case' 0 C--O 1.213 -0.821 0 C-N-CA 122.717 0.407 . . . . 72.33 110.968 176.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.494 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -60.06 -47.63 85.05 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 121.438 -0.105 . . . . 63.31 110.877 -177.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.585 ' CD1' HD22 ' A' ' 74' ' ' LEU . 5.8 m0 -58.84 -41.23 86.44 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.33 -0.989 . . . . 71.31 108.33 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.411 HD21 ' HB3' ' A' ' 14' ' ' ASP . 46.2 t30 -64.77 -52.49 56.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.239 -1.346 . . . . 74.32 110.976 -178.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -59.77 -32.71 70.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.94 0.496 . . . . 63.43 111.436 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 93.7 mt -68.89 -23.28 64.18 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.431 0.634 . . . . 64.33 111.26 177.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.457 ' HG3' ' O ' ' A' ' 83' ' ' TRP . 90.8 mtp -79.68 -34.37 40.31 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 122.091 -0.381 . . . . 51.3 109.986 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.409 HD12 ' HB2' ' A' ' 93' ' ' GLU . 3.1 mm? -70.07 -13.32 62.16 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 121.604 0.716 . . . . 71.14 109.667 172.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.5 m -86.56 0.54 54.14 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 121.347 0.594 . . . . 74.33 110.387 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -73.94 -41.83 61.46 Favored 'General case' 0 N--CA 1.425 -1.693 0 CA-C-O 121.072 0.463 . . . . 72.2 110.063 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 49.5 m -163.69 147.25 8.22 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 106.308 -1.738 . . . . 73.44 106.308 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -57.85 135.85 71.63 Favored 'Trans proline' 0 C--O 1.24 0.592 0 C-N-CA 122.255 1.97 . . . . 61.3 112.366 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.409 ' HB2' HD12 ' A' ' 88' ' ' LEU . 58.8 mt-10 . . . . . 0 N--CA 1.428 -1.536 0 N-CA-C 105.356 -2.091 . . . . 72.23 105.356 -179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.4 t70 . . . . . 0 CA--C 1.496 -1.121 0 N-CA-C 106.551 -1.648 . . . . 75.23 106.551 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.525 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 43.7 m-80 -150.64 117.78 5.97 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.624 0.577 . . . . 73.45 109.472 -178.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -82.71 15.31 2.69 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 112.462 0.541 . . . . 75.34 112.462 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -66.14 -20.56 66.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.959 -1.126 . . . . 54.31 107.959 172.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.4 -16.6 0.2 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.121 1.769 . . . . 53.14 112.604 174.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.57 -29.44 51.25 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 122.888 0.475 . . . . 64.14 110.318 173.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.444 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 31.7 t70 -64.07 -40.97 97.44 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.029 -0.73 . . . . 74.51 109.029 175.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.534 ' CE1' HD22 ' A' ' 24' ' ' LEU . 90.9 t80 -60.32 -22.85 63.7 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.636 0.774 . . . . 73.34 111.168 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -70.93 -21.58 62.34 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.632 -0.427 . . . . 73.52 110.224 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.612 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 67.5 mt-30 -75.4 -39.44 59.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.162 -1.051 . . . . 62.3 108.162 172.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.534 HD22 ' CE1' ' A' ' 21' ' ' TYR . 3.6 tt -59.95 -38.68 83.13 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 108.251 -1.018 . . . . 62.52 108.251 175.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.607 ' HD2' HD13 ' A' ' 80' ' ' LEU . 2.8 tpp180 -62.21 -47.83 82.71 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.052 -0.976 . . . . 72.5 110.14 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -51.69 -54.59 26.52 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.188 0.995 . . . . 72.02 110.169 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.612 ' HD2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -75.18 -18.59 60.14 Favored 'General case' 0 C--O 1.205 -1.257 0 C-N-CA 119.61 -0.836 . . . . 61.22 112.142 -177.749 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -25.9 64.4 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.714 0.293 . . . . 63.3 110.492 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.415 ' CD1' HD12 ' A' ' 39' ' ' LEU . 20.4 mm -62.88 -44.32 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 107.945 -1.132 . . . . 70.2 107.945 174.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -77.42 -34.32 54.74 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.144 -0.935 . . . . 54.22 111.335 -177.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.576 ' CD ' ' HD2' ' A' ' 54' ' ' ARG . 7.8 tp10 -44.6 -53.99 6.57 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 126.133 1.773 . . . . 71.22 113.357 -175.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.0 mt -113.86 13.65 18.43 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 119.986 -0.686 . . . . 64.41 110.566 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 54.52 65.89 1.38 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 122.716 1.246 . . . . 74.13 108.648 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.8 mt -100.48 132.66 45.74 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 114.401 -1.272 . . . . 65.4 110.306 -173.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.3 m -72.12 145.72 88.95 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 106.082 -1.821 . . . . 44.31 106.082 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.96 -29.55 21.6 Favored 'Trans proline' 0 N--CA 1.488 1.181 0 C-N-CA 122.703 2.269 . . . . 73.54 113.419 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.3 -14.21 60.48 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 122.735 0.414 . . . . 71.11 111.642 178.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 20.6 tp60 -104.98 -11.16 16.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.01 -0.737 . . . . 72.21 109.01 178.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.572 HD13 HD11 ' A' ' 80' ' ' LEU . 2.2 tm? -132.26 71.84 1.48 Allowed 'General case' 0 N--CA 1.432 -1.332 0 CA-C-O 122.21 1.005 . . . . 74.41 109.557 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' O ' HD12 ' A' ' 80' ' ' LEU . 42.5 t-80 -118.31 165.34 13.97 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 106.652 -1.61 . . . . 74.35 106.652 173.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' A' ' 81' ' ' ALA . 7.5 tp10 -44.04 -40.48 4.83 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 125.064 1.345 . . . . 65.01 113.338 -173.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.79 -2.72 47.09 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.966 -0.458 . . . . 74.45 111.651 -172.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 79' ' ' THR . 17.2 m -69.69 138.25 52.78 Favored 'General case' 0 C--O 1.248 1.012 0 CA-C-O 121.324 0.583 . . . . 61.22 112.031 -174.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.565 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.1 t-20 -79.88 120.07 23.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.461 -0.791 . . . . 72.11 110.861 -177.165 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 mt -79.05 -29.46 43.49 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 114.348 1.24 . . . . 74.12 114.348 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.1 mm -74.13 -29.99 26.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.14 -1.059 . . . . 70.3 108.14 177.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -31.54 71.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.419 -1.264 . . . . 75.4 109.641 176.014 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.62 -19.41 52.71 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.506 -0.77 . . . . 53.24 110.579 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.09 31.1 6.36 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.924 -0.655 . . . . 63.35 113.806 177.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tp -75.85 114.62 14.67 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.754 -1.202 . . . . 73.45 107.754 177.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -79.72 172.84 13.24 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.46 -0.496 . . . . 74.31 109.875 -175.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 18.9 m -78.52 -15.76 58.23 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.419 1.266 . . . . 71.21 114.419 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.586 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 49.6 mm -76.12 -40.32 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.556 0 N-CA-C 105.655 -1.979 . . . . 60.55 105.655 174.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.576 ' HD2' ' CD ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -53.17 -50.77 63.92 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.909 -1.145 . . . . 64.3 107.909 176.377 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.445 ' HB2' ' HA ' ' A' ' 52' ' ' SER . 67.7 mt -53.46 -51.55 62.36 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 113.992 -1.458 . . . . 75.42 111.988 176.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.429 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 21.7 ptp -77.97 -18.19 56.29 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 113.179 0.807 . . . . 64.51 113.179 -177.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.586 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 49.5 mtm180 -64.36 -44.93 89.88 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.176 -1.416 . . . . 74.43 107.176 173.027 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.453 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 17.1 m95 -64.45 -30.4 71.44 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.307 -1.315 . . . . 72.43 112.268 179.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.9 tp -56.75 -37.06 70.51 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.808 0.814 . . . . 74.01 110.781 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -79.12 -23.23 44.18 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.286 -0.87 . . . . 75.5 110.649 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.51 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 28.2 t90 -77.2 -30.59 54.82 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.717 -0.674 . . . . 72.22 109.352 -179.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.447 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 37.1 m-85 -69.68 -53.65 17.58 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-O 122.188 0.994 . . . . 74.33 108.609 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -62.43 -14.42 40.61 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 113.477 -1.692 . . . . 71.41 111.241 -174.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -50.94 -42.97 60.12 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.159 1.784 . . . . 73.01 111.035 173.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.491 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 3.1 m-20 -109.23 8.85 25.95 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 109.58 -0.526 . . . . 74.35 109.58 -177.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 8.93 64.25 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 120.447 -0.882 . . . . 75.02 112.657 -177.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 65' ' ' ASN . 59.2 m-85 -67.05 151.35 47.79 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 109.161 -0.681 . . . . 71.41 109.161 178.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.5 mtp180 -143.6 129.79 19.76 Favored 'General case' 0 C--N 1.274 -2.708 0 N-CA-C 113.556 0.947 . . . . 64.32 113.556 -168.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 ' CE2' ' A' ' 62' ' ' PHE . 3.7 pp -166.28 163.06 17.66 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-N 113.631 -1.622 . . . . 63.51 107.714 174.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.1 p -100.74 142.77 31.75 Favored 'General case' 0 N--CA 1.409 -2.476 0 N-CA-C 106.629 -1.619 . . . . 73.11 106.629 173.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.628 HD12 HD12 ' A' ' 74' ' ' LEU . 15.2 tp -67.01 -24.71 66.05 Favored 'General case' 0 C--N 1.293 -1.878 0 CA-C-O 120.708 0.29 . . . . 71.53 111.629 -173.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -66.51 -18.65 65.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 74.12 110.863 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -76.3 -29.4 57.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.767 0.794 . . . . 71.31 109.318 179.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.628 HD12 HD12 ' A' ' 71' ' ' LEU . 16.3 mt -77.31 -20.13 55.42 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.758 -1.11 . . . . 72.24 110.468 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -82.77 -37.98 23.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 74.54 109.387 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.04 -43.74 95.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.576 -0.738 . . . . 72.11 110.6 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.62 84.4 63.46 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 107.829 -1.174 . . . . 64.03 107.829 174.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.565 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 56.7 Cg_endo -79.89 86.57 1.65 Allowed 'Trans proline' 0 N--CA 1.434 -2.017 0 C-N-CA 121.187 1.258 . . . . 70.04 112.237 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 43' ' ' SER . 17.4 p -153.16 160.59 42.88 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 105.864 -1.902 . . . . 51.53 105.864 -179.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.607 HD13 ' HD2' ' A' ' 25' ' ' ARG . 64.2 mt -61.86 -44.63 96.43 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.585 0.707 . . . . 54.31 109.733 175.002 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.413 ' HA ' ' OE1' ' A' ' 41' ' ' GLU . . . -44.51 -44.17 8.44 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.22 -1.809 . . . . 61.22 113.281 -177.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.637 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -62.95 -49.14 75.91 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 120.908 -0.317 . . . . 61.2 111.438 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.553 ' CD1' HD22 ' A' ' 74' ' ' LEU . 1.7 m0 -61.4 -46.2 91.15 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.033 -1.099 . . . . 74.24 108.033 -175.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.65 -55.52 33.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.192 -1.367 . . . . 63.51 110.448 -179.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.77 -33.07 73.42 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.913 0.338 . . . . 73.14 111.913 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 95.1 mt -65.41 -28.8 69.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.838 0.352 . . . . 63.24 111.282 178.027 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 83' ' ' TRP . 76.3 mtp -80.88 -28.62 35.91 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 116.404 -0.362 . . . . 63.11 110.28 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 15' ' ' ASN . 7.4 mp -74.69 -30.96 61.74 Favored 'General case' 0 CA--C 1.502 -0.884 0 C-N-CA 119.498 -0.881 . . . . 70.02 110.362 174.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.1 m -78.77 -43.34 25.76 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.906 -0.588 . . . . 74.33 110.848 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -125.01 41.76 3.44 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 113.168 0.803 . . . . 73.41 113.168 -173.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.522 ' HB3' ' HD3' ' A' ' 92' ' ' PRO . 44.0 t -60.74 -52.14 74.66 Favored Pre-proline 0 C--N 1.284 -2.253 0 C-N-CA 118.741 -1.184 . . . . 72.02 110.006 168.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 91' ' ' SER . 39.6 Cg_endo -108.99 117.59 0.03 OUTLIER 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 121.785 1.657 . . . . 71.15 111.605 171.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 . . . . . 0 C--N 1.297 -1.692 0 N-CA-C 105.176 -2.157 . . . . 73.33 105.176 177.28 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 CA--C 1.507 -0.694 0 N-CA-C 105.48 -2.045 . . . . 73.12 105.48 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.502 ' OD1' ' HA ' ' A' ' 19' ' ' ALA . 23.8 t30 -168.29 24.33 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 118.415 0.552 . . . . 73.02 110.587 179.176 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.438 ' HB2' HD11 ' A' ' 88' ' ' LEU . 5.6 mpt_? -81.8 -77.57 0.22 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 117.734 -1.586 . . . . 72.32 109.736 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -79.74 -26.35 40.78 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.837 -1.542 . . . . 74.2 106.837 170.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.625 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -63.4 -13.58 41.33 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.171 -2.286 . . . . 60.03 112.6 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.502 ' HA ' ' OD1' ' A' ' 15' ' ' ASN . . . -50.31 -33.4 19.99 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.969 0.414 . . . . 62.22 110.904 173.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -66.35 -44.72 82.45 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 108.134 -1.061 . . . . 73.42 108.134 174.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.589 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 71.0 t80 -62.29 -22.82 66.33 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 114.649 -1.159 . . . . 71.05 110.805 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.16 -33.69 76.02 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.448 -0.575 . . . . 73.33 109.448 176.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.44 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 21.3 mm-40 -74.03 -36.92 64.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.173 -0.467 . . . . 70.33 109.819 175.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.6 tt -63.2 -37.02 85.6 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.937 -0.764 . . . . 62.45 108.937 174.353 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.556 ' HD2' HD13 ' A' ' 80' ' ' LEU . 3.2 tpp180 -58.78 -52.25 66.51 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 123.792 0.837 . . . . 75.24 109.781 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -56.24 -47.14 79.1 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-N 115.376 -0.829 . . . . 63.23 109.37 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 14.9 mmp_? -61.62 -46.24 90.63 Favored 'General case' 0 C--O 1.198 -1.648 0 CA-C-N 115.026 -0.988 . . . . 74.04 110.151 179.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 1.2 tt -59.91 -38.8 83.37 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.585 0.754 . . . . 74.41 111.261 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.608 HG12 HD23 ' A' ' 39' ' ' LEU . 61.4 mt -59.82 -49.03 85.41 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-O 120.884 0.373 . . . . 70.11 110.164 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.406 ' H ' ' HG2' ' A' ' 30' ' ' GLN . 7.3 pt20 -77.75 -19.2 55.55 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 112.715 0.635 . . . . 73.15 112.715 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 11.3 tp10 -55.94 -53.11 60.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.687 1.195 . . . . 74.45 110.707 176.746 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.507 ' HB2' ' CD1' ' A' ' 34' ' ' LEU . 96.4 mt -97.32 -3.97 39.47 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 119.529 -0.868 . . . . 53.44 111.405 175.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 71.57 42.91 0.63 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.845 0.858 . . . . 72.14 110.493 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.507 ' CD1' ' HB2' ' A' ' 32' ' ' LEU . 3.2 mp -83.1 -179.85 7.54 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 107.984 -1.117 . . . . 72.03 107.984 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.412 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 37.6 p -130.49 158.67 73.84 Favored Pre-proline 0 C--N 1.285 -2.207 0 N-CA-C 106.305 -1.739 . . . . 74.42 106.305 173.262 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -66.57 -1.65 6.09 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 C-N-CA 121.969 1.779 . . . . 51.14 112.027 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -81.08 -22.02 39.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.849 -0.797 . . . . 63.1 108.849 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 35' ' ' THR . 11.5 pt20 -121.53 9.21 10.21 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.426 -0.806 . . . . 74.31 109.879 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.608 HD23 HG12 ' A' ' 29' ' ' ILE . 28.1 tp -142.83 105.66 4.52 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.644 -0.822 . . . . 72.32 112.083 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.411 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 32.0 t-80 -131.1 167.37 19.23 Favored 'General case' 0 C--N 1.287 -2.151 0 C-N-CA 125.7 1.6 . . . . 75.24 107.201 176.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -42.19 -39.8 2.16 Favored 'General case' 0 CA--C 1.561 1.38 0 C-N-CA 124.617 1.167 . . . . 73.43 113.897 -177.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.411 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -89.47 -5.71 57.1 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.943 -0.473 . . . . 64.23 111.912 -171.62 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.417 ' O ' ' HA ' ' A' ' 79' ' ' THR . 16.5 m -68.78 128.79 37.92 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 121.264 0.554 . . . . 65.42 111.828 -175.108 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.543 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 43.1 t-20 -74.4 116.02 14.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.442 -0.799 . . . . 51.45 110.315 -179.192 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.598 ' HB3' HD12 ' A' ' 50' ' ' LEU . 54.6 mt -79.11 -23.86 43.79 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.98 1.474 . . . . 74.1 114.98 -175.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.418 HG12 ' CB ' ' A' ' 78' ' ' PRO . 37.3 mm -75.87 -35.55 30.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 N-CA-C 108.757 -0.831 . . . . 73.41 108.757 178.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -76.83 -15.5 59.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.296 -0.865 . . . . 72.02 110.162 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.15 -21.32 46.65 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.835 -0.802 . . . . 72.14 108.835 175.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.97 25.58 5.58 Favored Glycine 0 N--CA 1.43 -1.76 0 N-CA-C 115.112 0.805 . . . . 63.43 115.112 174.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.598 HD12 ' HB3' ' A' ' 45' ' ' LEU . 65.3 mt -73.25 109.24 6.62 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 118.168 0.984 . . . . 73.44 110.154 174.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.433 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.0 p30 -71.97 169.64 15.49 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.253 -1.017 . . . . 75.55 108.253 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 56' ' ' MET . 28.3 m -74.11 -14.61 61.0 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 115.104 1.52 . . . . 50.05 115.104 -172.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.402 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.5 mm -78.17 -38.44 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 C-N-CA 117.62 -1.632 . . . . 73.32 107.891 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 4.8 mmm-85 -58.42 -46.23 86.89 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 106.172 -1.788 . . . . 73.41 106.172 177.317 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.51 ' HG ' HD11 ' A' ' 71' ' ' LEU . 12.3 tp -59.96 -47.23 86.64 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.008 -1.906 . . . . 62.34 111.438 -177.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 52' ' ' SER . 19.9 ptp -83.55 -18.55 37.97 Favored 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 120.046 -0.662 . . . . 74.43 112.022 -176.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 36.8 mtm105 -63.4 -36.99 85.55 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.696 -0.853 . . . . 73.42 108.696 172.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.44 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 10.8 m95 -65.7 -32.25 73.71 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.508 -1.224 . . . . 74.52 112.54 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.2 tp -58.13 -31.49 67.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.488 0.661 . . . . 73.11 110.959 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -81.65 -30.99 32.54 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.186 -0.461 . . . . 74.11 109.936 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.613 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 23.7 t90 -70.1 -33.0 71.32 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.725 -0.67 . . . . 72.14 111.129 -175.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.454 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 72.4 m-85 -64.54 -47.78 77.52 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.108 0.956 . . . . 71.03 110.906 177.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.527 ' HA ' ' O ' ' A' ' 67' ' ' TYR . 58.6 mtm180 -64.59 -13.19 52.06 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 115.479 1.659 . . . . 72.11 115.479 -169.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.613 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 18.8 mtmm -52.52 -45.67 66.37 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 121.639 0.733 . . . . 73.23 110.561 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -95.82 11.28 34.19 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 115.056 -0.974 . . . . 71.31 110.571 -171.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 87.68 8.87 72.73 Favored Glycine 0 N--CA 1.429 -1.773 0 C-N-CA 120.155 -1.021 . . . . 54.14 111.195 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.527 ' O ' ' HA ' ' A' ' 63' ' ' ARG . 23.4 m-85 -74.75 158.61 33.23 Favored 'General case' 0 CA--C 1.473 -2.016 0 N-CA-C 109.001 -0.74 . . . . 70.4 109.001 176.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.626 ' NH2' ' HB2' ' A' ' 93' ' ' GLU . 10.6 ptm180 -155.14 135.78 13.48 Favored 'General case' 0 C--N 1.257 -3.452 0 CA-C-N 114.99 -1.005 . . . . 74.22 110.999 -167.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -167.95 163.91 13.8 Favored 'General case' 0 C--N 1.29 -2.011 0 O-C-N 124.444 1.09 . . . . 74.22 108.341 171.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 62.0 p -101.73 142.33 33.23 Favored 'General case' 0 N--CA 1.412 -2.334 0 N-CA-C 107.505 -1.294 . . . . 62.11 107.505 173.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.52 HD12 HD12 ' A' ' 74' ' ' LEU . 15.1 tp -64.58 -24.49 67.62 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.748 0.785 . . . . 73.34 109.826 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.402 ' HE ' ' HB3' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -51.58 -27.5 11.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.622 1.569 . . . . 74.32 110.4 174.483 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -85.3 -28.27 25.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.954 -0.566 . . . . 74.34 110.457 -177.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.52 HD12 HD12 ' A' ' 71' ' ' LEU . 15.9 mt -78.32 -22.91 47.39 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.547 -0.751 . . . . 74.22 110.238 -178.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -78.85 -38.27 38.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.993 -0.549 . . . . 73.12 109.644 172.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.69 84.44 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.587 -0.733 . . . . 73.21 110.816 -178.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.44 86.11 58.92 Favored Pre-proline 0 N--CA 1.43 -1.428 0 N-CA-C 109.028 -0.73 . . . . 72.31 109.028 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.543 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 40.9 Cg_endo -86.78 86.43 0.81 Allowed 'Trans proline' 0 N--CA 1.425 -2.538 0 C-N-CA 121.041 1.161 . . . . 71.13 112.45 -176.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' A' ' 43' ' ' SER . 15.3 p -152.84 152.32 31.43 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 105.618 -1.993 . . . . 63.31 105.618 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.563 HD11 ' HG ' ' A' ' 39' ' ' LEU . 43.4 mt -54.67 -47.25 73.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 118.637 0.653 . . . . 71.13 111.255 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.09 -40.43 23.26 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 114.207 -1.361 . . . . 75.32 112.778 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.458 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -65.42 -49.55 68.77 Favored 'General case' 0 C--O 1.208 -1.123 0 O-C-N 123.479 0.487 . . . . 63.31 111.753 -178.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.48 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -66.01 -38.3 88.12 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 106.993 -1.484 . . . . 73.41 106.993 -176.208 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -57.41 -51.47 69.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.199 -1.819 . . . . 70.13 111.276 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -73.34 -31.24 63.85 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 116.413 -0.358 . . . . 74.11 111.117 -179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 78.7 mt -60.26 -38.9 84.94 Favored 'General case' 0 C--O 1.19 -2.048 0 N-CA-C 113.246 0.832 . . . . 74.42 113.246 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.625 ' SD ' ' HA ' ' A' ' 18' ' ' ALA 0.264 16.7 ptp -67.84 -35.23 78.21 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 117.86 -1.536 . . . . 72.25 112.305 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.438 HD11 ' HB2' ' A' ' 16' ' ' ARG . 4.5 mm? -68.16 -46.04 71.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 120.428 -0.509 . . . . 73.15 111.927 171.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.6 t -70.88 -27.02 63.5 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 111.962 0.356 . . . . 50.21 111.962 -177.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -103.89 21.24 16.67 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.852 -0.158 . . . . 63.53 110.791 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 71.1 m -61.62 123.53 77.25 Favored Pre-proline 0 N--CA 1.44 -0.927 0 N-CA-C 106.676 -1.602 . . . . 71.24 106.676 172.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -7.4 116.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.375 1.955 1 C-N-CA 126.753 4.969 . . . . 55.45 118.417 -163.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.626 ' HB2' ' NH2' ' A' ' 68' ' ' ARG . 11.0 mt-10 . . . . . 0 N--CA 1.44 -0.963 0 N-CA-C 104.367 -2.457 . . . . 63.34 104.367 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 t0 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 107.676 -1.231 . . . . 72.129999999999995 107.676 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.517 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 17.5 m120 -142.96 108.95 5.19 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 112.071 0.397 . . . . 55.109999999999999 112.071 -171.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' A' ' 93' ' ' GLU . 0.4 OUTLIER -111.64 -76.81 0.59 Allowed 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.109 -1.071 . . . . 74.019999999999996 108.109 173.702 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.759 ' HB3' ' HB3' ' A' ' 93' ' ' GLU . 14.3 t-80 -79.31 -32.95 43.57 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 105.409 -2.071 . . . . 61.539999999999999 105.409 169.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.517 ' HB3' ' HA ' ' A' ' 15' ' ' ASN . . . -52.26 -14.29 0.43 Allowed 'General case' 0 C--O 1.208 -1.091 0 CA-C-N 111.979 -2.373 . . . . 62.340000000000003 111.946 173.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.17 -21.78 0.54 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.769 0.828 . . . . 73.420000000000002 112.122 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.77 -45.44 74.25 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 108.509 -0.923 . . . . 73.140000000000001 108.509 171.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.516 ' CE1' HD22 ' A' ' 24' ' ' LEU . 82.4 t80 -59.85 -25.32 64.93 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.616 -0.72 . . . . 70.439999999999998 111.072 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -62.4 -41.29 98.55 Favored 'General case' 0 C--O 1.191 -2.003 0 N-CA-C 108.584 -0.895 . . . . 64.109999999999999 108.584 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -66.11 -33.01 74.82 Favored 'General case' 0 C--O 1.241 0.642 0 O-C-N 123.347 0.404 . . . . 72.129999999999995 111.974 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.545 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 4.6 tt -61.93 -37.49 84.87 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 108.44 -0.948 . . . . 73.439999999999998 108.44 173.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.439 ' HA ' ' HB2' ' A' ' 28' ' ' LEU . 52.6 ttp180 -84.46 -37.59 21.18 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.012 -0.995 . . . . 75.239999999999995 111.802 -173.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -58.11 -40.03 80.14 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.367 -0.833 . . . . 72.340000000000003 109.224 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -72.24 -42.92 65.1 Favored 'General case' 0 N--CA 1.432 -1.337 0 C-N-CA 120.498 -0.481 . . . . 71.349999999999994 110.408 172.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 25' ' ' ARG . 1.2 tt -51.0 -35.58 34.78 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.335 1.054 . . . . 54.340000000000003 112.404 -177.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.1 mt -58.29 -51.32 72.68 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 CA-C-O 120.616 0.246 . . . . 70.019999999999996 111.239 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -81.2 -19.14 43.92 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.586 -0.445 . . . . 62.299999999999997 112.068 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -55.28 -53.38 56.8 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.43 0.692 . . . . 72.349999999999994 110.63 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.0 mt -97.53 -0.6 45.66 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 119.379 -0.929 . . . . 73.540000000000006 111.174 174.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 t30 61.15 69.66 0.65 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.476 1.132 . . . . 73.420000000000002 108.745 -172.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.6 mt -103.86 150.98 23.65 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.287 -1.324 . . . . 71.310000000000002 109.65 -176.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 m -83.93 147.79 52.29 Favored Pre-proline 0 C--N 1.289 -2.04 0 N-CA-C 106.9 -1.519 . . . . 73.5 106.9 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -55.14 -29.4 65.89 Favored 'Trans proline' 0 N--CA 1.487 1.11 0 C-N-CA 121.943 1.762 . . . . 73.349999999999994 112.426 176.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.71 -0.18 37.23 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 121.107 0.479 . . . . 71.230000000000004 110.48 177.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -116.39 -4.82 11.78 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 107.932 -1.136 . . . . 71.030000000000001 107.932 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -142.84 78.44 1.61 Allowed 'General case' 0 N--CA 1.421 -1.901 0 CA-C-O 122.227 1.013 . . . . 71.549999999999997 111.161 -175.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.424 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 30.0 t-80 -120.94 165.46 15.2 Favored 'General case' 0 C--N 1.278 -2.513 0 N-CA-C 104.093 -2.558 . . . . 71.549999999999997 104.093 169.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 80' ' ' LEU 0.464 8.0 pt-20 -60.36 -16.68 37.42 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 117.897 2.555 . . . . 73.200000000000003 117.897 -171.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -93.16 -11.2 33.35 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.675 0.67 . . . . 74.150000000000006 109.908 -179.007 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 m -64.46 136.62 57.26 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-N 115.571 -0.74 . . . . 73.349999999999994 110.422 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.434 ' O ' ' HB3' ' A' ' 47' ' ' GLN . 0.8 OUTLIER -81.87 126.74 32.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.313 0.578 . . . . 74.239999999999995 110.68 -176.385 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.422 HD11 HD23 ' A' ' 80' ' ' LEU . 75.5 mt -77.56 -35.54 53.04 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 113.976 1.102 . . . . 72.209999999999994 113.976 -176.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.453 HG12 ' CB ' ' A' ' 78' ' ' PRO . 48.2 mm -71.49 -26.55 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 108.304 -0.999 . . . . 73.209999999999994 108.304 175.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.434 ' HB3' ' O ' ' A' ' 44' ' ' ASN . 53.2 tt0 -69.48 -32.74 71.84 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.617 -1.174 . . . . 71.430000000000007 109.336 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.31 -13.36 55.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.416 -0.811 . . . . 74.209999999999994 110.879 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.46 35.45 6.95 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.998 -0.62 . . . . 71.319999999999993 113.499 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.6 tp -74.24 106.41 5.87 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 108.585 -0.894 . . . . 74.140000000000001 108.585 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.585 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 3.7 p30 -64.24 163.35 12.95 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.069 -0.969 . . . . 72.129999999999995 110.673 -178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.438 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 19.8 m -74.74 -14.08 60.68 Favored 'General case' 0 N--CA 1.416 -2.163 0 N-CA-C 114.125 1.158 . . . . 72.150000000000006 114.125 -176.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.595 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 46.3 mm -73.42 -42.55 56.7 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.354 0 N-CA-C 106.704 -1.591 . . . . 75.219999999999999 106.704 175.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.585 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 3.4 mpt_? -56.63 -47.03 80.58 Favored 'General case' 0 CA--C 1.507 -0.702 0 O-C-N 123.545 0.528 . . . . 72.109999999999999 109.662 174.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 51' ' ' ASP . 65.6 mt -53.22 -47.0 69.34 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.083 -0.962 . . . . 70.319999999999993 110.831 177.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 66.7 mtt -81.11 -19.06 44.42 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.546 0.573 . . . . 53.409999999999997 112.546 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 4.1 mmp_? -73.97 -42.0 61.12 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.44 0.638 . . . . 75.209999999999994 109.351 177.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.545 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 8.8 m95 -64.64 -28.36 69.56 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.436 -1.257 . . . . 72.519999999999996 113.781 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.87 -39.08 73.67 Favored 'General case' 0 C--O 1.242 0.674 0 CA-C-O 120.969 0.414 . . . . 72.230000000000004 110.896 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -69.52 -32.44 71.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.012 -0.54 . . . . 74.019999999999996 109.937 179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.537 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 2.7 t90 -72.62 -29.96 63.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.472 -0.785 . . . . 74.120000000000005 110.044 -175.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.427 ' CD2' HD11 ' A' ' 69' ' ' LEU . 64.2 m-85 -73.12 -53.29 11.4 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-O 121.747 0.784 . . . . 71.040000000000006 110.516 175.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -64.92 -14.85 61.07 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 114.851 -1.068 . . . . 74.519999999999996 111.062 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -48.9 -46.82 43.39 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.334 1.854 . . . . 73.200000000000003 111.85 175.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.495 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 3.5 m-20 -104.67 14.47 29.72 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-O 121.611 0.719 . . . . 52.140000000000001 109.221 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 79.83 16.98 76.09 Favored Glycine 0 N--CA 1.417 -2.574 0 CA-C-N 115.298 -0.865 . . . . 73.25 112.423 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.495 ' CE1' ' HB2' ' A' ' 65' ' ' ASN . 43.1 m-85 -63.22 159.91 16.73 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 117.524 0.662 . . . . 65.219999999999999 110.126 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.405 ' HD2' ' N ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -125.94 91.88 3.48 Favored 'General case' 0 C--N 1.285 -2.199 0 C-N-CA 117.856 -1.538 . . . . 73.299999999999997 112.982 -160.104 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.427 HD11 ' CD2' ' A' ' 62' ' ' PHE . 3.7 pp -158.1 165.61 34.57 Favored 'General case' 0 C--N 1.307 -1.244 0 C-N-CA 119.708 -0.797 . . . . 73.329999999999998 111.667 176.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.7 p -120.72 144.67 48.11 Favored 'General case' 0 N--CA 1.415 -2.217 0 N-CA-C 108.258 -1.016 . . . . 54.240000000000002 108.258 176.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.499 HD12 HD12 ' A' ' 74' ' ' LEU . 33.8 tp -62.04 -25.17 67.52 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.037 0.754 . . . . 65.420000000000002 113.037 -174.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.429 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 19.5 ptt180 -56.34 -25.82 50.47 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 121.43 0.633 . . . . 73.120000000000005 109.464 178.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 72' ' ' ARG . 40.3 mt-10 -86.09 -23.16 26.79 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.143 -0.935 . . . . 64.420000000000002 109.817 -173.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.515 HD22 ' CG ' ' A' ' 83' ' ' TRP . 19.3 mt -83.41 -24.55 31.87 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.009 -0.996 . . . . 73.310000000000002 109.31 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -78.68 -42.77 27.63 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 115.333 -0.848 . . . . 73.200000000000003 109.653 171.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.89 -47.01 87.51 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.543 -0.753 . . . . 44.329999999999998 111.38 -177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.75 87.27 56.88 Favored Pre-proline 0 N--CA 1.43 -1.466 0 N-CA-C 108.536 -0.913 . . . . 65.409999999999997 108.536 175.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.453 ' CB ' HG12 ' A' ' 46' ' ' ILE . 58.9 Cg_endo -85.83 85.82 1.05 Allowed 'Trans proline' 0 N--CA 1.422 -2.721 0 C-N-CA 120.658 0.906 . . . . 74.450000000000003 112.756 -175.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.5 p -151.29 144.06 24.42 Favored 'General case' 0 C--N 1.288 -2.067 0 N-CA-C 105.806 -1.924 . . . . 73.219999999999999 105.806 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 41' ' ' GLU . 52.4 mt -52.92 -45.81 67.78 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 123.771 0.67 . . . . 75.219999999999999 110.698 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.88 -43.8 39.38 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 114.427 -1.26 . . . . 40.32 112.05 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.603 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.5 -51.96 63.33 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.765 -0.374 . . . . 64.310000000000002 110.826 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.515 ' CG ' HD22 ' A' ' 74' ' ' LEU . 3.3 m0 -60.19 -36.68 78.18 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 122.031 0.92 . . . . 75.099999999999994 108.734 -176.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -71.41 -51.26 24.98 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.449 -1.251 . . . . 75.439999999999998 111.54 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -71.23 -18.82 62.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 112.095 0.406 . . . . 73.219999999999999 112.095 -176.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 92.6 mt -63.02 -19.05 63.99 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.91 0.386 . . . . 74.5 110.792 173.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 62.6 mtt -77.17 -61.51 1.96 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.597 -0.89 . . . . 73.230000000000004 108.597 173.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.448 HD22 ' H ' ' A' ' 88' ' ' LEU . 2.4 mm? -62.98 -31.34 72.44 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.751 1.019 . . . . 53.340000000000003 113.751 -176.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.2 t -79.78 -5.62 55.69 Favored 'General case' 0 C--N 1.311 -1.106 0 O-C-N 121.904 -0.498 . . . . 63.009999999999998 111.943 -175.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -115.54 -1.22 12.82 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.251 0.548 . . . . 75.239999999999995 111.62 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.8 p 179.71 118.37 0.21 Allowed Pre-proline 0 N--CA 1.432 -1.328 0 N-CA-C 106.319 -1.734 . . . . 45.229999999999997 106.319 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -66.77 117.43 4.76 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 120.954 1.103 . . . . 72.030000000000001 110.514 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.759 ' HB3' ' HB3' ' A' ' 17' ' ' HIS . 27.7 mt-10 . . . . . 0 C--O 1.27 2.141 0 N-CA-C 107.321 -1.363 . . . . 65.319999999999993 107.321 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 . . . . . 0 C--O 1.214 -0.81 0 N-CA-C 108.646 -0.872 . . . . 73.540000000000006 108.646 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 45.51 37.35 3.03 Favored 'General case' 0 C--N 1.375 1.716 0 C-N-CA 125.279 1.432 . . . . 55.43 113.846 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -56.98 -48.24 78.88 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.734 1.013 . . . . 72.120000000000005 113.734 -176.107 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -77.8 -39.19 44.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.752 0.787 . . . . 71.25 110.049 178.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.457 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -64.8 -15.56 61.87 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.475 -1.239 . . . . 71.530000000000001 113.705 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -53.27 -38.61 63.22 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.2 0.2 . . . . 62.43 111.175 174.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 38.5 t70 -76.63 -26.29 54.74 Favored 'General case' 0 C--O 1.217 -0.626 0 N-CA-C 109.092 -0.707 . . . . 73.310000000000002 109.092 177.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.515 ' CE2' HD22 ' A' ' 24' ' ' LEU . 65.6 t80 -63.9 -22.78 67.08 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.266 -0.425 . . . . 71.030000000000001 110.133 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -60.08 -36.58 77.69 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.291 -0.633 . . . . 74.140000000000001 109.291 176.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.425 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 5.7 tt0 -64.34 -42.56 96.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.601 -0.727 . . . . 72.129999999999995 109.47 176.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.515 HD22 ' CE2' ' A' ' 21' ' ' TYR . 5.9 tt -66.1 -40.07 90.48 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.693 -0.484 . . . . 72.230000000000004 109.693 177.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.603 ' HD2' HD13 ' A' ' 80' ' ' LEU . 2.7 tpp85 -60.79 -48.1 83.32 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.147 -0.686 . . . . 74.409999999999997 109.147 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 28.6 tt0 -49.76 -48.94 50.01 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 125.698 1.599 . . . . 70.239999999999995 110.159 177.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.482 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 89.0 mtt180 -81.94 -18.44 43.55 Favored 'General case' 0 N--CA 1.426 -1.645 0 N-CA-C 113.86 1.059 . . . . 74.439999999999998 113.86 -173.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 28' ' ' LEU . 28.0 mt -70.92 -38.16 72.93 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 120.277 -0.569 . . . . 74.319999999999993 110.059 171.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.475 HG23 ' O ' ' A' ' 34' ' ' LEU . 62.2 mt -62.81 -39.95 86.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 107.842 -1.17 . . . . 71.010000000000005 107.842 175.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -61.9 -59.34 5.27 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 114.762 -1.108 . . . . 63.020000000000003 111.654 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 27' ' ' ARG . 50.3 mt-10 -55.6 -54.45 43.96 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 113.906 1.076 . . . . 70.420000000000002 113.906 -173.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.571 HD11 HD23 ' A' ' 50' ' ' LEU . 88.3 mt -97.17 6.65 48.11 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.012 -1.075 . . . . 72.219999999999999 113.042 -174.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 54.36 45.03 28.01 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 122.86 1.314 . . . . 63.409999999999997 108.914 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.509 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 37.6 mt -79.33 129.96 34.98 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 114.479 -1.237 . . . . 72.450000000000003 108.66 -175.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.8 m -70.82 141.95 87.71 Favored Pre-proline 0 N--CA 1.421 -1.896 0 N-CA-C 106.069 -1.826 . . . . 74.510000000000005 106.069 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.52 -30.1 52.7 Favored 'Trans proline' 0 N--CA 1.487 1.108 0 C-N-CA 122.284 1.99 . . . . 73.519999999999996 112.606 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 -68.35 -25.02 64.88 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.201 -0.454 . . . . 72.209999999999994 110.94 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.449 ' O ' ' HB3' ' A' ' 43' ' ' SER . 49.4 tt0 -89.57 -38.96 13.59 Favored 'General case' 0 N--CA 1.434 -1.268 0 N-CA-C 108.718 -0.845 . . . . 71.420000000000002 108.718 177.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.509 HD23 HD13 ' A' ' 34' ' ' LEU . 1.7 tm? -88.06 65.28 8.13 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-O 123.018 1.39 . . . . 73.519999999999996 110.262 -175.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -96.68 164.14 12.71 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 112.892 -1.958 . . . . 72.049999999999997 106.381 175.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 11.4 mm-40 -51.53 -29.91 18.55 Favored 'General case' 0 N--CA 1.503 2.213 0 CA-C-O 122.101 0.953 . . . . 74.219999999999999 110.906 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -80.26 -10.05 59.75 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 127.731 2.412 . . . . 75.549999999999997 112.795 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.555 ' O ' ' HA ' ' A' ' 79' ' ' THR . 54.1 p -64.59 119.2 10.04 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 112.899 0.703 . . . . 74.409999999999997 112.899 -176.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.523 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 42.8 t-20 -73.92 105.26 5.1 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.25 -1.018 . . . . 75.420000000000002 108.25 174.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.507 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 76.7 mt -70.32 -23.02 62.77 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 114.822 1.416 . . . . 72.430000000000007 114.822 -174.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.447 HG12 ' CB ' ' A' ' 78' ' ' PRO . 46.0 mm -73.53 -39.87 54.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.539 -0.911 . . . . 73.239999999999995 108.539 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -77.37 -18.08 57.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.185 -0.916 . . . . 71.239999999999995 110.052 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.5 -27.27 55.97 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.17 -0.678 . . . . 75.510000000000005 109.17 175.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.65 38.46 0.91 Allowed Glycine 0 N--CA 1.434 -1.473 0 C-N-CA 120.511 -0.852 . . . . 41.32 115.103 175.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.571 HD23 HD11 ' A' ' 32' ' ' LEU . 34.4 mt -89.21 103.25 15.89 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.385 -0.969 . . . . 75.25 108.385 173.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.586 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 4.0 p30 -67.8 159.04 31.1 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 108.624 -0.88 . . . . 74.230000000000004 108.624 177.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.5 m -66.57 -17.98 65.12 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.52 1.304 . . . . 53.520000000000003 114.52 -175.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 51.5 mm -77.12 -48.23 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.808 0 C-N-CA 117.821 -1.552 . . . . 75.230000000000004 107.909 178.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.586 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 29.2 mtp180 -65.54 -35.05 79.7 Favored 'General case' 0 CA--C 1.504 -0.814 0 O-C-N 123.904 0.752 . . . . 73.409999999999997 110.755 177.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.483 ' HG ' HD11 ' A' ' 71' ' ' LEU . 14.3 tp -57.88 -44.18 86.51 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.393 -0.965 . . . . 70.420000000000002 108.393 175.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 53.5 ttm -81.22 -20.28 41.41 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.26 -0.882 . . . . 71.140000000000001 111.125 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 5.4 mmp_? -65.37 -40.59 93.71 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.73 -1.211 . . . . 74.549999999999997 107.73 176.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -62.53 -33.14 74.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.12 -1.4 . . . . 74.129999999999995 111.801 176.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 61.9 tp -57.11 -43.52 82.36 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 120.741 0.305 . . . . 71.150000000000006 110.576 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -67.23 -36.54 81.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.315 0.579 . . . . 73.420000000000002 109.612 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.624 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 70.8 t90 -64.25 -36.61 84.64 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 115.136 -0.938 . . . . 73.310000000000002 110.259 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.52 ' CD1' HD11 ' A' ' 69' ' ' LEU . 49.7 m-85 -70.38 -58.23 3.97 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.454 0.645 . . . . 65.420000000000002 111.453 177.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.448 ' NH2' ' HA ' ' A' ' 68' ' ' ARG . 0.9 OUTLIER -65.01 -16.1 63.06 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.251 -0.886 . . . . 72.299999999999997 112.085 -172.693 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.8 pttm -56.27 -39.59 72.88 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 122.932 0.493 . . . . 75.219999999999999 111.608 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.465 ' HB3' ' CE1' ' A' ' 67' ' ' TYR . 66.1 t30 -114.93 24.79 11.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 122.33 1.062 . . . . 63.210000000000001 108.285 -175.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 71.37 26.17 73.94 Favored Glycine 0 N--CA 1.437 -1.249 0 CA-C-N 114.432 -1.258 . . . . 63.200000000000003 114.159 177.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.465 ' CE1' ' HB3' ' A' ' 65' ' ' ASN . 60.9 m-85 -69.98 142.33 52.85 Favored 'General case' 0 CA--C 1.475 -1.906 0 CA-C-N 118.072 0.936 . . . . 72.230000000000004 110.394 177.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.507 ' NH1' ' HA ' ' A' ' 69' ' ' LEU . 0.0 OUTLIER -98.32 91.54 5.27 Favored 'General case' 0 C--N 1.284 -2.25 0 CA-C-N 114.971 -1.013 . . . . 74.299999999999997 112.196 -163.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.564 HD22 HD21 ' A' ' 74' ' ' LEU . 4.5 pp -168.28 148.9 4.86 Favored 'General case' 0 CA--C 1.486 -1.484 0 O-C-N 123.928 0.768 . . . . 64.450000000000003 111.22 168.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.574 ' HB ' ' OE1' ' A' ' 73' ' ' GLU . 0.2 OUTLIER -103.75 168.71 8.96 Favored 'General case' 0 N--CA 1.399 -3.009 0 N-CA-C 103.74 -2.689 . . . . 54.009999999999998 103.74 171.426 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.525 HD12 HD12 ' A' ' 74' ' ' LEU . 14.0 tp -79.28 -23.75 43.38 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 119.317 -0.953 . . . . 61.25 112.176 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 24.6 tpt85 -60.34 -27.72 67.58 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 120.696 0.284 . . . . 75.510000000000005 110.402 -178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.574 ' OE1' ' HB ' ' A' ' 70' ' ' THR . 2.6 mp0 -71.94 -40.01 69.02 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.976 0.894 . . . . 65.040000000000006 109.849 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.564 HD21 HD22 ' A' ' 69' ' ' LEU . 15.8 mt -67.81 -27.94 67.15 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 114.22 -1.355 . . . . 75.140000000000001 110.636 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.439 ' CZ ' HD23 ' A' ' 55' ' ' LEU . 54.8 m-85 -84.0 -3.64 58.15 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.014 -0.539 . . . . 74.200000000000003 110.819 173.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.93 -49.32 5.35 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.173 -0.677 . . . . 75.319999999999993 109.173 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.96 88.72 53.79 Favored Pre-proline 0 N--CA 1.429 -1.496 0 N-CA-C 108.334 -0.987 . . . . 72.239999999999995 108.334 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.523 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 10.8 Cg_endo -88.27 86.59 0.58 Allowed 'Trans proline' 0 N--CA 1.423 -2.625 0 C-N-CA 121.139 1.226 . . . . 73.230000000000004 112.516 -177.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.555 ' HA ' ' O ' ' A' ' 43' ' ' SER . 13.7 p -151.5 151.02 31.05 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 105.935 -1.876 . . . . 52.539999999999999 105.935 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.603 HD13 ' HD2' ' A' ' 25' ' ' ARG . 89.7 mt -50.45 -48.5 56.42 Favored 'General case' 0 CA--C 1.5 -0.964 0 O-C-N 123.647 0.592 . . . . 73.25 110.977 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.492 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -44.82 -46.9 10.92 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 113.594 -1.639 . . . . 40.420000000000002 112.144 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.577 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -64.81 -53.03 53.32 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-O 119.242 -0.408 . . . . 54.119999999999997 111.819 -177.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.423 ' CG ' HD22 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -62.7 -34.95 78.2 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 108.326 -0.99 . . . . 74.510000000000005 108.326 -175.571 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -65.89 -51.65 56.92 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 114.311 -1.313 . . . . 51.399999999999999 110.605 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -72.37 -29.64 63.96 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 116.109 -0.496 . . . . 74.040000000000006 111.486 -178.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 81.6 mt -56.68 -28.09 60.09 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.213 0.449 . . . . 70.299999999999997 112.213 178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 55.3 mtt -68.31 -54.99 13.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.648 -0.501 . . . . 71.319999999999993 109.648 174.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.94 -46.11 46.18 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.398 1.259 . . . . 73.409999999999997 114.398 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 m -73.35 2.55 7.34 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.767 0.794 . . . . 72.219999999999999 111.768 -175.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.628 ' HA ' ' NE ' ' A' ' 90' ' ' ARG . 1.4 mmp_? -120.92 -66.11 1.08 Allowed 'General case' 0 N--CA 1.418 -2.038 0 CA-C-N 115.614 -0.721 . . . . 71.299999999999997 112.069 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.431 ' HB2' ' CD ' ' A' ' 92' ' ' PRO 0.254 12.2 m 64.69 -84.3 0.0 OUTLIER Pre-proline 0 CA--C 1.596 2.721 0 CA-C-O 117.675 -1.155 . . . . 51.439999999999998 110.936 -167.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.605 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 73.0 Cg_endo -79.32 167.64 21.11 Favored 'Trans proline' 0 C--N 1.399 3.231 0 CA-C-N 123.211 2.183 . . . . 74.030000000000001 110.016 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.424 ' CD ' ' HE ' ' A' ' 68' ' ' ARG . 11.3 mm-40 . . . . . 0 C--O 1.263 1.792 0 C-N-CA 123.993 0.917 . . . . 61.409999999999997 112.672 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 p30 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 112.859 0.689 . . . . 71.030000000000001 112.859 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.47 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 20.1 m-80 -137.05 21.82 3.02 Favored 'General case' 0 C--O 1.206 -1.22 0 N-CA-C 115.901 1.815 . . . . 70.530000000000001 115.901 -174.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.543 ' HD2' ' H ' ' A' ' 16' ' ' ARG 0.425 0.1 OUTLIER -65.71 -74.7 0.1 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.532 -2.067 . . . . 74.400000000000006 113.999 178.292 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.503 ' HB2' HD21 ' A' ' 88' ' ' LEU . 64.4 m-70 -78.91 -21.97 46.56 Favored 'General case' 0 C--N 1.315 -0.922 0 O-C-N 121.134 -0.979 . . . . 74.340000000000003 110.007 173.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.558 ' HB2' HD23 ' A' ' 88' ' ' LEU . . . -69.54 -15.86 63.31 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 114.47 -1.241 . . . . 74.439999999999998 112.572 -177.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.94 60.0 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.119 0.485 . . . . 62.009999999999998 110.166 174.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -65.49 -34.73 78.94 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.697 -0.683 . . . . 73.129999999999995 109.431 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.535 ' CE1' HD22 ' A' ' 24' ' ' LEU . 91.1 t80 -63.3 -30.14 71.33 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.151 -0.477 . . . . 70.219999999999999 110.402 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.471 ' HA ' ' HB3' ' A' ' 25' ' ' ARG . 2.7 mp0 -67.27 -22.85 65.64 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 120.863 0.363 . . . . 73.340000000000003 111.7 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -78.14 -24.55 47.34 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.272 0.558 . . . . 73.299999999999997 110.428 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.637 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 2.0 tt -74.45 -48.99 24.14 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.453 -1.314 . . . . 64.400000000000006 107.453 171.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.504 ' HD2' HD13 ' A' ' 80' ' ' LEU . 27.7 ttt180 -57.45 -39.87 77.22 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 124.974 1.309 . . . . 73.0 114.043 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -50.43 -49.11 55.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.121 0.962 . . . . 74.430000000000007 108.812 176.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.85 -17.89 32.26 Favored 'General case' 0 N--CA 1.427 -1.614 0 CA-C-N 114.687 -1.142 . . . . 65.0 112.706 -177.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.443 HD12 ' CD2' ' A' ' 24' ' ' LEU . 1.2 tt -63.05 -42.79 99.8 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 108.752 -0.833 . . . . 73.349999999999994 108.752 174.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 63.1 mt -68.15 -27.61 37.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-N 114.78 -1.1 . . . . 70.409999999999997 110.023 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -74.92 -50.82 15.53 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.275 -0.875 . . . . 74.0 110.841 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.265 43.6 mt-10 -62.11 -29.12 70.11 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 116.229 1.937 . . . . 64.519999999999996 116.229 -174.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.498 HD12 HD11 ' A' ' 34' ' ' LEU . 46.0 mt -99.52 -4.06 32.07 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 118.435 -1.306 . . . . 73.310000000000002 112.255 170.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 t30 58.46 69.1 0.76 Allowed 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 122.497 1.141 . . . . 61.329999999999998 108.388 -172.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.498 HD11 HD12 ' A' ' 32' ' ' LEU . 17.8 mt -109.13 163.09 13.65 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.133 -1.394 . . . . 65.439999999999998 109.666 -174.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 37.4 p -113.0 156.81 42.21 Favored Pre-proline 0 C--N 1.287 -2.112 0 N-CA-C 107.693 -1.225 . . . . 75.450000000000003 107.693 174.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -62.67 -17.29 58.03 Favored 'Trans proline' 0 N--CA 1.485 0.983 0 C-N-CA 122.397 2.064 . . . . 72.319999999999993 113.127 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -87.0 -29.99 21.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.232 0.539 . . . . 75.299999999999997 109.568 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -79.54 -48.11 14.39 Favored 'General case' 0 N--CA 1.432 -1.329 0 N-CA-C 108.722 -0.844 . . . . 72.450000000000003 108.722 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.02 76.83 1.95 Allowed 'General case' 0 N--CA 1.407 -2.581 0 N-CA-C 108.797 -0.816 . . . . 55.549999999999997 108.797 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -74.02 151.78 40.16 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 105.597 -2.001 . . . . 74.329999999999998 105.597 170.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.564 ' HA ' HD12 ' A' ' 80' ' ' LEU 0.354 5.1 pt-20 -68.37 -14.29 62.89 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 115.972 1.841 . . . . 74.150000000000006 115.972 -173.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -112.12 23.57 13.57 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.326 1.06 . . . . 63.32 108.423 174.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 29.9 t -91.9 151.44 20.53 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.056 -1.091 . . . . 62.229999999999997 108.056 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.501 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 19.2 t-20 -78.37 111.76 14.69 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.213 0.53 . . . . 75.310000000000002 111.398 -174.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.627 ' HB3' HD12 ' A' ' 50' ' ' LEU . 20.8 mt -66.24 -26.39 67.34 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 114.346 1.239 . . . . 65.409999999999997 114.346 -178.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 38.7 mm -72.42 -40.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.16 -0.616 . . . . 72.030000000000001 109.364 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -74.96 -16.43 60.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 72.549999999999997 110.311 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.61 -20.68 59.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.861 -0.792 . . . . 61.039999999999999 108.861 174.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.17 22.61 6.44 Favored Glycine 0 N--CA 1.43 -1.707 0 N-CA-C 115.251 0.861 . . . . 70.140000000000001 115.251 174.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.627 HD12 ' HB3' ' A' ' 45' ' ' LEU . 57.8 mt -69.67 110.31 4.8 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 118.213 1.006 . . . . 70.409999999999997 111.094 176.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 55' ' ' LEU . 3.4 p30 -75.07 169.24 18.4 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 107.896 -1.15 . . . . 73.450000000000003 107.896 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -73.36 -14.41 61.28 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 114.854 1.427 . . . . 74.129999999999995 114.854 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 50.7 mm -80.34 -46.36 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.193 0 N-CA-C 106.792 -1.558 . . . . 72.299999999999997 106.792 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.533 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 61.8 mtm180 -66.24 -20.75 66.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 121.307 0.575 . . . . 62.350000000000001 111.959 175.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.611 ' HG ' HD11 ' A' ' 71' ' ' LEU . 9.7 tp -78.58 -42.2 29.78 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.544 -0.91 . . . . 75.140000000000001 108.544 175.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.5 ttm -80.16 -18.77 48.8 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.878 -0.601 . . . . 71.239999999999995 110.094 -175.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' A' ' 54' ' ' ARG . 7.5 mmm180 -47.26 -43.24 21.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.136 1.375 . . . . 74.319999999999993 109.712 172.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.637 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 32.7 m95 -83.82 -26.05 29.85 Favored 'General case' 0 N--CA 1.425 -1.685 0 CA-C-N 113.878 -1.51 . . . . 70.200000000000003 113.856 -176.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.6 -42.25 74.58 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.919 0.39 . . . . 53.210000000000001 111.207 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -81.14 -26.53 36.02 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.15 0.5 . . . . 72.5 109.798 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.542 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 39.9 t90 -66.79 -42.57 85.77 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.74 -0.663 . . . . 65.439999999999998 109.679 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.501 ' CE2' HD21 ' A' ' 69' ' ' LEU . 64.7 m-85 -57.58 -48.78 78.44 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 122.352 1.073 . . . . 71.299999999999997 110.533 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -69.97 -12.83 61.9 Favored 'General case' 0 C--N 1.291 -1.955 0 CA-C-N 114.336 -1.302 . . . . 72.019999999999996 113.842 -172.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -58.78 -30.02 67.24 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 120.834 0.349 . . . . 63.340000000000003 110.649 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.36 8.18 35.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 109.433 -0.58 . . . . 70.420000000000002 109.433 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 77.65 30.87 51.88 Favored Glycine 0 N--CA 1.433 -1.543 0 C-N-CA 120.664 -0.779 . . . . 25.030000000000001 111.522 -175.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . 0.272 28.1 m-85 -74.65 165.2 25.6 Favored 'General case' 0 CA--C 1.487 -1.469 0 C-N-CA 119.383 -0.927 . . . . 74.310000000000002 112.34 178.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -124.12 94.97 4.38 Favored 'General case' 0 C--N 1.288 -2.069 0 C-N-CA 118.994 -1.083 . . . . 65.430000000000007 112.976 -160.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.501 HD21 ' CE2' ' A' ' 62' ' ' PHE . 3.4 pp -167.88 163.42 13.91 Favored 'General case' 0 C--O 1.256 1.413 0 N-CA-C 112.741 0.645 . . . . 72.230000000000004 112.741 171.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 77.7 p -112.77 154.5 26.11 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 106.208 -1.775 . . . . 63.299999999999997 106.208 171.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.691 HD12 HD12 ' A' ' 74' ' ' LEU . 19.2 tp -72.5 -23.98 61.1 Favored 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 120.678 -0.409 . . . . 71.510000000000005 111.058 -176.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -65.53 -19.86 66.1 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-O 120.833 0.349 . . . . 74.519999999999996 110.557 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -78.08 -31.42 50.13 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.047 0.927 . . . . 65.109999999999999 108.849 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.691 HD12 HD12 ' A' ' 71' ' ' LEU . 65.9 mt -77.6 -17.02 58.23 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.971 -1.468 . . . . 75.329999999999998 111.757 -176.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -81.18 -37.22 29.08 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.127 -0.694 . . . . 73.329999999999998 109.127 172.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.65 -46.69 62.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.307 -0.86 . . . . 62.030000000000001 110.656 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.11 83.08 56.23 Favored Pre-proline 0 N--CA 1.434 -1.26 0 N-CA-C 109.154 -0.684 . . . . 51.25 109.154 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.515 ' HA ' ' HE1' ' A' ' 83' ' ' TRP . 15.3 Cg_endo -95.27 86.7 0.11 Allowed 'Trans proline' 0 N--CA 1.417 -2.979 0 C-N-CA 121.337 1.358 . . . . 50.43 112.656 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 50.0 p -146.69 149.25 33.08 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 104.967 -2.234 . . . . 72.319999999999993 104.967 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 41' ' ' GLU . 81.7 mt -53.76 -43.54 69.27 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 118.43 0.559 . . . . 73.430000000000007 111.808 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -57.39 -43.23 83.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.18 -0.918 . . . . 44.43 111.546 -179.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.539 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.63 -48.05 78.85 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.79 -0.186 . . . . 73.219999999999999 111.438 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.515 ' HE1' ' HA ' ' A' ' 78' ' ' PRO . 5.8 m0 -62.05 -38.0 87.11 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.017 -0.735 . . . . 75.219999999999999 109.017 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -61.83 -54.8 37.17 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.85 -1.068 . . . . 61.140000000000001 110.093 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.404 ' HG2' ' CD ' ' A' ' 93' ' ' GLU . 90.5 mt-30 -69.45 -29.23 66.88 Favored 'General case' 0 C--O 1.2 -1.514 0 CA-C-N 115.563 -0.744 . . . . 63.329999999999998 112.802 -177.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 67.8 mt -59.08 -18.81 38.57 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.02 0.827 . . . . 74.230000000000004 112.933 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.8 mtt -73.97 -57.46 3.96 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.448 0.642 . . . . 73.129999999999995 109.277 172.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.649 ' HB3' ' HA ' ' A' ' 93' ' ' GLU . 3.9 mm? -88.87 -31.4 18.28 Favored 'General case' 0 C--O 1.19 -2.079 0 N-CA-C 116.619 2.081 . . . . 73.430000000000007 116.619 -170.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.0 p -64.37 -5.32 4.99 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-N 119.5 1.046 . . . . 71.430000000000007 113.658 -174.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 mtt-85 -95.6 5.78 50.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.052 -1.092 . . . . 73.109999999999999 108.052 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 50.8 m -150.29 -161.37 0.05 OUTLIER Pre-proline 0 CA--C 1.569 1.685 0 N-CA-C 104.138 -2.542 . . . . 65.340000000000003 104.138 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -62.37 118.85 5.75 Favored 'Trans proline' 0 C--N 1.366 1.468 0 CA-C-N 122.771 2.026 . . . . 72.120000000000005 110.207 170.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.649 ' HA ' ' HB3' ' A' ' 88' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.428 0 O-C-N 123.875 0.735 . . . . 70.129999999999995 109.241 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 . . . . . 0 C--O 1.213 -0.827 0 N-CA-C 107.47 -1.307 . . . . 71.049999999999997 107.47 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -153.58 126.5 8.34 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.758 -0.777 . . . . 71.040000000000006 112.947 -173.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.293 0.0 OUTLIER -110.08 -75.82 0.62 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.481 0.548 . . . . 74.310000000000002 112.481 175.568 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -79.19 -30.84 43.62 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 104.688 -2.338 . . . . 54.409999999999997 104.688 169.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.27 -13.97 0.14 Allowed 'General case' 0 C--O 1.197 -1.674 0 CA-C-N 112.578 -2.101 . . . . 55.310000000000002 112.372 169.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.547 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -45.04 -22.02 0.08 Allowed 'General case' 0 C--O 1.199 -1.585 0 C-N-CA 123.906 0.882 . . . . 71.310000000000002 112.854 175.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.555 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 25.2 t70 -51.61 -42.39 61.93 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.121 -0.696 . . . . 64.030000000000001 109.121 170.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.695 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 75.1 t80 -59.12 -24.29 62.86 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 123.916 0.886 . . . . 75.140000000000001 110.71 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.547 ' HB2' ' O ' ' A' ' 19' ' ' ALA . 4.6 mm100 -57.91 -43.92 86.48 Favored 'General case' 0 C--O 1.189 -2.119 0 C-N-CA 120.354 -0.538 . . . . 73.299999999999997 112.206 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . 0.292 26.6 mp0 -72.46 -19.67 61.52 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 113.144 0.794 . . . . 73.510000000000005 113.144 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.515 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 5.0 tt -73.69 -32.61 64.04 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.659 -1.237 . . . . 71.109999999999999 107.659 170.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.2 ttp180 -83.26 -45.04 14.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.076 -0.966 . . . . 75.049999999999997 110.718 -173.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -60.88 -34.45 74.66 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 114.744 -1.116 . . . . 74.150000000000006 109.465 176.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 23.6 ttt85 -73.02 -42.14 63.51 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 119.393 -0.923 . . . . 73.340000000000003 110.357 172.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.417 HD21 ' HE1' ' A' ' 58' ' ' TRP . 15.6 mt -52.77 -36.73 58.45 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.489 0.922 . . . . 64.140000000000001 113.489 177.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.419 HG23 ' O ' ' A' ' 34' ' ' LEU . 61.0 mt -57.66 -45.3 86.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 O-C-N 123.728 0.643 . . . . 54.340000000000003 110.514 176.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -82.27 -34.6 28.67 Favored 'General case' 0 C--N 1.309 -1.163 0 O-C-N 121.909 -0.495 . . . . 53.119999999999997 111.338 -179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -49.51 -49.98 43.62 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.075 1.35 . . . . 73.349999999999994 111.715 -175.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD11 HD23 ' A' ' 50' ' ' LEU . 96.4 mt -110.91 11.41 22.3 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.252 -0.579 . . . . 73.430000000000007 112.034 176.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.73 37.77 22.01 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.844 0.831 . . . . 51.240000000000002 111.146 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.479 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 29.5 mt -80.31 129.48 34.53 Favored 'General case' 0 N--CA 1.432 -1.332 0 N-CA-C 108.171 -1.048 . . . . 74.450000000000003 108.171 -177.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -71.06 145.96 92.09 Favored Pre-proline 0 C--N 1.297 -1.691 0 N-CA-C 107.131 -1.433 . . . . 62.140000000000001 107.131 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -57.76 -16.25 24.47 Favored 'Trans proline' 0 N--CA 1.494 1.545 0 C-N-CA 122.508 2.138 . . . . 75.409999999999997 112.665 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -78.02 -23.14 48.33 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-O 121.272 0.558 . . . . 74.230000000000004 109.669 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -95.41 -43.64 7.91 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 108.791 -0.818 . . . . 74.439999999999998 108.791 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.443 HD23 HD13 ' A' ' 34' ' ' LEU . 2.4 tm? -85.75 76.74 9.89 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-O 122.463 1.125 . . . . 74.329999999999998 110.068 -175.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.532 ' O ' HD12 ' A' ' 80' ' ' LEU . 48.0 t-80 -112.67 164.75 12.97 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 105.395 -2.076 . . . . 73.310000000000002 105.395 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 23.7 mm-40 -46.89 -48.95 21.06 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 119.287 0.948 . . . . 64.430000000000007 111.321 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -80.1 24.25 0.43 Allowed 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 125.377 1.471 . . . . 71.150000000000006 113.864 -177.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.632 ' O ' ' HA ' ' A' ' 79' ' ' THR . 37.4 p -85.42 130.82 34.5 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 121.417 -0.802 . . . . 55.32 111.118 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.516 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 48.1 t-20 -78.96 100.67 7.38 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 108.97 -0.752 . . . . 70.120000000000005 108.97 177.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.503 ' HB3' HD12 ' A' ' 50' ' ' LEU . 82.3 mt -68.29 -17.3 64.24 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 114.42 1.267 . . . . 72.319999999999993 114.42 -175.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.9 mm -78.71 -34.16 17.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 108.83 -0.804 . . . . 72.129999999999995 108.83 177.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -77.89 -22.99 48.92 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.429 -0.805 . . . . 64.25 109.68 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.09 -27.53 62.72 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.254 -0.885 . . . . 41.049999999999997 109.684 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.33 32.22 2.83 Favored Glycine 0 N--CA 1.439 -1.121 0 C-N-CA 120.51 -0.852 . . . . 51.130000000000003 115.218 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.503 HD23 HD11 ' A' ' 32' ' ' LEU . 76.5 mt -76.38 104.24 6.8 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 118.006 0.903 . . . . 53.329999999999998 110.374 174.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -64.34 158.84 22.46 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 107.966 -1.124 . . . . 73.510000000000005 107.966 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.8 m -65.62 -24.68 67.11 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 114.183 1.179 . . . . 65.299999999999997 114.183 -172.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.694 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 47.4 mm -76.43 -45.35 34.24 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.349 0 C-N-CA 118.108 -1.437 . . . . 62.039999999999999 107.594 178.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.473 ' HA ' ' NE ' ' A' ' 57' ' ' ARG . 10.7 ttm180 -55.85 -39.0 70.84 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.196 -0.911 . . . . 73.299999999999997 108.57 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.424 HD13 ' CE1' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -67.11 -54.45 21.26 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.142 -1.39 . . . . 73.230000000000004 111.193 177.722 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.439 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 22.2 ptm -72.89 -18.59 61.4 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 113.535 0.939 . . . . 73.120000000000005 113.535 -174.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.694 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 67.0 mtm180 -56.79 -37.89 71.78 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 108.126 -1.065 . . . . 73.340000000000003 108.126 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.515 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 21.6 m95 -65.59 -25.28 67.33 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 113.884 -1.507 . . . . 64.239999999999995 112.585 -176.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 64.3 tp -56.53 -40.54 75.26 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.214 0.53 . . . . 55.130000000000003 111.168 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -79.85 -30.67 40.41 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.796 -0.638 . . . . 70.109999999999999 109.5 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.562 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 14.6 t90 -64.13 -38.67 91.91 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.612 -0.722 . . . . 73.25 109.679 -177.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.458 ' CE1' HD21 ' A' ' 69' ' ' LEU . 52.0 m-85 -63.14 -54.14 42.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 121.678 0.751 . . . . 75.209999999999994 111.485 176.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.79 -14.79 63.24 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.802 -1.09 . . . . 75.319999999999993 111.528 -174.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.562 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 0.0 OUTLIER -53.72 -39.07 64.94 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 125.032 1.333 . . . . 74.219999999999999 111.383 173.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -114.58 27.97 9.07 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 122.376 1.084 . . . . 74.209999999999994 109.482 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 72.21 33.94 61.57 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 114.842 -1.072 . . . . 61.399999999999999 113.387 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -95.58 167.78 11.09 Favored 'General case' 0 CA--C 1.488 -1.405 0 C-N-CA 119.999 -0.68 . . . . 74.200000000000003 111.283 176.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.417 ' CG ' ' HB3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -140.38 107.67 5.52 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 115.048 1.499 . . . . 73.400000000000006 115.048 -165.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.458 HD21 ' CE1' ' A' ' 62' ' ' PHE . 4.1 pp -168.12 160.56 11.92 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.966 -1.015 . . . . 72.209999999999994 108.548 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.604 ' HB ' ' OE1' ' A' ' 73' ' ' GLU . 10.4 m -115.64 170.62 8.3 Favored 'General case' 0 N--CA 1.402 -2.862 0 N-CA-C 105.706 -1.961 . . . . 75.439999999999998 105.706 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 74' ' ' LEU . 4.7 tp -79.17 -23.41 43.94 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.563 -0.711 . . . . 71.340000000000003 112.461 -173.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -62.85 -27.33 69.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.886 0.374 . . . . 70.340000000000003 110.324 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' OE1' ' HB ' ' A' ' 70' ' ' THR . 2.3 mp0 -77.65 -36.29 51.65 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.044 -0.98 . . . . 72.109999999999999 109.464 -178.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.586 HD12 HD12 ' A' ' 71' ' ' LEU . 17.0 mt -68.48 -28.88 67.42 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 114.196 -1.365 . . . . 70.349999999999994 109.134 177.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.424 ' CE1' HD13 ' A' ' 55' ' ' LEU . 7.6 m-85 -87.06 4.92 40.06 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.203 -0.908 . . . . 70.209999999999994 111.471 173.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -100.15 -47.81 4.84 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 108.221 -1.029 . . . . 51.030000000000001 108.221 176.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.94 90.04 51.66 Favored Pre-proline 0 N--CA 1.433 -1.315 0 N-CA-C 107.83 -1.174 . . . . 53.420000000000002 107.83 174.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.516 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 50.2 Cg_endo -81.95 87.17 1.45 Allowed 'Trans proline' 0 N--CA 1.434 -2.027 0 C-N-CA 121.269 1.313 . . . . 71.540000000000006 112.947 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.632 ' HA ' ' O ' ' A' ' 43' ' ' SER . 2.6 p -155.31 148.56 24.84 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 107.199 -1.408 . . . . 73.239999999999995 107.199 178.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' ' 40' ' ' HIS . 69.4 mt -52.19 -47.51 65.51 Favored 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 123.625 0.578 . . . . 72.420000000000002 110.367 177.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.406 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -44.69 -43.87 8.69 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-N 113.397 -1.728 . . . . 63.140000000000001 112.185 -179.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.559 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -63.15 -51.23 67.25 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 121.046 -0.261 . . . . 61.520000000000003 111.173 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.498 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -64.23 -36.18 83.24 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 107.778 -1.193 . . . . 73.209999999999994 107.778 -175.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -65.28 -52.91 51.19 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 113.816 -1.538 . . . . 73.409999999999997 111.675 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -66.19 -27.57 68.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.686 0.279 . . . . 72.540000000000006 110.971 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 98.5 mt -64.61 -19.78 65.88 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.104 -0.498 . . . . 75.010000000000005 111.472 176.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.695 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 41.7 mtt -76.67 -45.73 28.51 Favored 'General case' 0 C--O 1.204 -1.331 0 CA-C-N 116.636 -0.256 . . . . 74.319999999999993 110.406 173.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -69.3 -11.44 60.81 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.568 0.699 . . . . 72.409999999999997 110.66 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.2 m -82.97 11.29 6.35 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-N 116.089 -0.505 . . . . 72.109999999999999 111.791 176.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.669 ' HG3' ' O ' ' A' ' 87' ' ' MET . 0.1 OUTLIER -95.08 -27.25 15.69 Favored 'General case' 0 CA--C 1.512 -0.484 0 C-N-CA 119.668 -0.813 . . . . 64.400000000000006 112.554 177.51 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.8 p -169.91 161.62 6.85 Favored Pre-proline 0 C--N 1.316 -0.89 0 N-CA-C 107.532 -1.284 . . . . 53.549999999999997 107.532 178.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -59.1 118.66 5.58 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.337 1.358 . . . . 55.219999999999999 109.278 173.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 . . . . . 0 N--CA 1.412 -2.336 0 N-CA-C 103.416 -2.809 . . . . 71.340000000000003 103.416 -176.234 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 CA--C 1.509 -0.599 0 N-CA-C 107.647 -1.242 . . . . 61.240000000000002 107.647 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -149.58 25.95 0.85 Allowed 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 109.066 -0.716 . . . . 75.549999999999997 109.066 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.632 ' HD3' ' H ' ' A' ' 17' ' ' HIS 0.567 0.0 OUTLIER -100.23 -74.06 0.62 Allowed 'General case' 0 N--CA 1.427 -1.598 0 C-N-CA 119.068 -1.053 . . . . 72.340000000000003 113.307 172.991 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.632 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 6.9 m170 -79.8 -27.65 40.33 Favored 'General case' 0 C--O 1.213 -0.826 0 O-C-N 121.163 -0.961 . . . . 73.400000000000006 109.229 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.535 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -66.19 -15.05 62.83 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.042 -0.981 . . . . 60.0 110.917 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.67 -28.97 66.22 Favored 'General case' 0 CA--C 1.543 0.68 0 O-C-N 121.922 -0.486 . . . . 75.030000000000001 110.17 173.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -69.01 -33.82 74.26 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.767 0.794 . . . . 71.040000000000006 108.932 176.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.535 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 89.8 t80 -61.45 -22.86 65.43 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 114.987 -1.006 . . . . 63.409999999999997 110.05 177.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -67.05 -24.16 65.96 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 116.481 -0.327 . . . . 73.209999999999994 111.45 176.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -76.89 -33.22 57.83 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 120.816 0.341 . . . . 74.400000000000006 110.829 173.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.492 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 5.8 tt -62.14 -43.79 98.06 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 107.313 -1.366 . . . . 72.200000000000003 107.313 170.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.632 ' HD3' HD21 ' A' ' 80' ' ' LEU . 42.9 ttp180 -67.79 -36.43 80.45 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-N 114.414 -1.266 . . . . 72.329999999999998 113.408 -176.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -58.48 -38.76 78.28 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 108.537 -0.912 . . . . 74.219999999999999 108.537 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.431 ' HD2' ' N ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -79.52 -31.78 42.19 Favored 'General case' 0 C--O 1.195 -1.793 0 C-N-CA 120.336 -0.546 . . . . 73.329999999999998 111.267 176.645 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.527 HD13 HD12 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -59.92 -36.94 78.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 118.118 0.417 . . . . 71.530000000000001 110.617 179.444 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.575 HD13 HD13 ' A' ' 39' ' ' LEU . 15.5 mm -58.84 -46.86 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-O 121.934 0.873 . . . . 72.219999999999999 108.678 174.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -69.87 -42.81 72.98 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.677 -1.147 . . . . 75.030000000000001 111.818 -177.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.459 ' CD ' ' HE ' ' A' ' 54' ' ' ARG . 5.7 mm-40 -47.44 -54.1 12.31 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.625 1.17 . . . . 75.099999999999994 113.937 -177.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.498 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 96.0 mt -103.47 9.8 37.51 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.1 -1.04 . . . . 74.140000000000001 112.276 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.46 28.75 16.95 Favored 'General case' 0 N--CA 1.495 1.791 0 CA-C-O 121.705 0.764 . . . . 61.030000000000001 110.602 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.498 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 21.9 mt -80.64 129.9 34.79 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 107.329 -1.36 . . . . 63.030000000000001 107.329 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 35.6 p -78.95 157.38 76.31 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 108.593 -0.891 . . . . 61.030000000000001 108.593 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -67.11 -1.98 7.19 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.082 1.855 . . . . 61.140000000000001 113.346 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -98.02 -17.29 19.23 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 108.191 -1.04 . . . . 74.040000000000006 108.191 175.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -100.72 -39.45 7.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 114.67 -1.15 . . . . 74.540000000000006 108.331 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.575 HD13 HD13 ' A' ' 29' ' ' ILE . 1.4 tt -100.65 92.48 5.13 Favored 'General case' 0 N--CA 1.419 -2.01 0 CA-C-N 115.261 -0.881 . . . . 75.120000000000005 108.926 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -101.09 164.2 11.92 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 105.124 -2.176 . . . . 75.120000000000005 105.124 168.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.406 ' HB3' HD22 ' A' ' 80' ' ' LEU 0.34 14.3 pt-20 -77.6 -15.06 59.46 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 117.365 -1.734 . . . . 50.109999999999999 114.459 -169.897 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -81.68 -1.36 46.57 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.73 -0.668 . . . . 73.420000000000002 110.693 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 46.8 m -69.97 135.96 49.98 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-O 120.996 0.427 . . . . 71.200000000000003 111.416 178.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.564 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 44.4 t-20 -77.08 105.77 8.36 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.566 -1.272 . . . . 72.340000000000003 107.566 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 98.4 mt -66.24 -25.15 66.76 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.815 1.043 . . . . 73.239999999999995 113.815 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.6 mm -71.68 -34.38 52.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.698 -0.853 . . . . 75.329999999999998 108.698 178.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -80.09 -15.35 57.32 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.653 -0.703 . . . . 53.539999999999999 110.185 178.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.24 -11.23 55.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.792 -0.64 . . . . 73.239999999999995 109.355 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.47 30.04 10.35 Favored Glycine 0 N--CA 1.431 -1.648 0 CA-C-N 115.14 -0.936 . . . . 63.119999999999997 113.827 176.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -74.79 105.2 5.74 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 108.146 -1.057 . . . . 61.539999999999999 108.146 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.596 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.7 p30 -61.66 157.98 16.41 Favored 'General case' 0 C--O 1.252 1.2 0 CA-C-N 115.105 -0.952 . . . . 74.140000000000001 110.881 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.4 m -68.88 -16.91 63.89 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 113.05 0.759 . . . . 74.239999999999995 113.05 -177.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.52 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 43.2 mm -75.68 -39.94 39.76 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.679 0 C-N-CA 118.298 -1.361 . . . . 74.439999999999998 107.476 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.596 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 1.8 mpt_? -54.86 -49.27 71.54 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 109.36 -0.607 . . . . 73.239999999999995 109.36 173.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.527 ' HG ' HD11 ' A' ' 71' ' ' LEU . 5.6 tp -59.88 -40.15 87.74 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.136 -1.393 . . . . 75.019999999999996 110.443 -177.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.6 mtt -83.16 -24.76 32.36 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 112.422 0.527 . . . . 72.329999999999998 112.422 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 44.9 mtm180 -68.3 -41.95 80.16 Favored 'General case' 0 N--CA 1.44 -0.93 0 N-CA-C 107.763 -1.199 . . . . 75.549999999999997 107.763 173.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.492 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 6.7 m95 -60.94 -41.97 97.29 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 114.618 -1.174 . . . . 74.109999999999999 112.796 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 63' ' ' ARG . 67.3 tp -52.83 -41.56 64.34 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.429 0.633 . . . . 71.510000000000005 110.554 177.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -81.11 -21.06 40.19 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.494 -0.776 . . . . 74.140000000000001 112.299 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -65.81 -52.12 53.24 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.03 -1.1 . . . . 73.530000000000001 108.03 174.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -55.38 -50.43 69.73 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 121.881 0.848 . . . . 75.299999999999997 108.801 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 25.2 ttt180 -60.88 -28.34 68.81 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 113.689 -1.596 . . . . 72.0 111.091 -175.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HA ' ' CE ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -83.15 -34.34 26.05 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 113.878 1.066 . . . . 72.129999999999995 113.878 176.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -78.63 -11.51 59.97 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 124.135 0.897 . . . . 72.129999999999995 111.72 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.69 6.62 49.56 Favored Glycine 0 CA--C 1.503 -0.684 0 N-CA-C 110.815 -0.914 . . . . 64.319999999999993 110.815 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -86.03 166.88 15.51 Favored 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 114.929 -0.635 . . . . 73.439999999999998 110.088 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.65 ' NH2' ' HA ' ' A' ' 92' ' ' PRO . 10.7 ptt180 -153.2 121.13 6.09 Favored 'General case' 0 C--N 1.294 -1.83 0 C-N-CA 118.903 -1.119 . . . . 72.25 113.419 -166.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.1 pp -168.09 171.33 9.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.675 1.19 . . . . 65.430000000000007 108.631 174.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 81.1 p -109.5 142.92 39.87 Favored 'General case' 0 N--CA 1.423 -1.814 0 N-CA-C 109.212 -0.662 . . . . 51.439999999999998 109.212 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.527 HD11 ' HG ' ' A' ' 55' ' ' LEU . 23.8 tp -64.53 -24.31 67.56 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 112.174 0.435 . . . . 65.25 112.174 -176.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -60.02 -23.36 63.62 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.931 -0.577 . . . . 73.109999999999999 110.192 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -78.97 -39.48 34.23 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.262 -0.881 . . . . 65.430000000000007 110.13 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 71' ' ' LEU . 6.1 mp -65.55 -27.93 68.8 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 124.138 0.975 . . . . 71.510000000000005 111.052 177.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.446 ' CZ ' HD23 ' A' ' 55' ' ' LEU . 45.1 m-85 -80.44 -37.76 31.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.008 -0.542 . . . . 72.430000000000007 110.915 173.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -64.23 -47.07 81.08 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.065 0.46 . . . . 74.120000000000005 110.978 -178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -123.21 87.38 51.43 Favored Pre-proline 0 C--N 1.308 -1.236 0 N-CA-C 108.303 -0.999 . . . . 73.450000000000003 108.303 175.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.564 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 20.5 Cg_endo -83.36 86.77 1.36 Allowed 'Trans proline' 0 N--CA 1.417 -2.993 0 C-N-CA 120.915 1.077 . . . . 62.140000000000001 112.502 -175.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.1 p -151.98 145.74 25.06 Favored 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 106.041 -1.837 . . . . 53.329999999999998 106.041 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.632 HD21 ' HD3' ' A' ' 25' ' ' ARG . 9.0 tt -66.25 -38.08 87.01 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-O 120.774 0.321 . . . . 74.430000000000007 110.763 -175.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 84' ' ' ASN . . . -59.63 -28.07 66.9 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 123.458 0.703 . . . . 65.439999999999998 110.806 177.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.613 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.24 -46.75 69.62 Favored 'General case' 0 C--O 1.2 -1.541 0 CA-C-N 115.753 -0.658 . . . . 63.520000000000003 110.683 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -66.27 -34.76 78.72 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.221 -1.029 . . . . 75.310000000000002 108.221 -176.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.413 ' HB3' ' O ' ' A' ' 81' ' ' ALA . 48.5 t-20 -54.3 -55.44 28.33 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 114.675 -1.148 . . . . 74.519999999999996 108.566 176.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -71.5 -33.01 68.86 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-N 115.464 -0.789 . . . . 75.010000000000005 111.987 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 82.4 mt -56.85 -36.82 70.47 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 111.834 0.309 . . . . 60.219999999999999 111.834 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.501 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 36.9 mtt -53.61 -61.01 2.58 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.68 0.612 . . . . 64.109999999999999 109.354 173.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.42 -17.13 63.62 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 114.442 1.275 . . . . 75.420000000000002 114.442 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.8 m -78.34 -15.96 58.19 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.514 0.673 . . . . 71.349999999999994 110.093 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 13.1 mmt180 -109.49 11.85 24.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.398 -1.334 . . . . 63.32 107.398 175.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.4 m 31.91 85.6 0.15 Allowed Pre-proline 0 C--O 1.234 0.241 0 C-N-CA 128.555 2.742 . . . . 74.540000000000006 115.514 175.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.65 ' HA ' ' NH2' ' A' ' 68' ' ' ARG . 11.8 Cg_endo -94.66 115.09 0.2 Allowed 'Trans proline' 0 N--CA 1.421 -2.793 0 C-N-CA 120.891 1.061 . . . . 62.420000000000002 110.486 174.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 127.978 2.511 . . . . 71.420000000000002 114.369 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.4 t0 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 106.411 -1.7 . . . . 62.240000000000002 106.411 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 19' ' ' ALA . 17.1 m120 -139.21 108.52 6.11 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 117.912 0.324 . . . . 51.140000000000001 111.697 -171.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.634 ' HB2' ' OXT' ' A' ' 93' ' ' GLU . 0.7 OUTLIER -110.8 -76.76 0.6 Allowed 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.298 -1.001 . . . . 73.019999999999996 108.298 174.561 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -77.8 -28.5 50.44 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-O 122.887 1.327 . . . . 64.409999999999997 107.882 169.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' A' ' 15' ' ' ASN . . . -58.89 -12.7 4.77 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 112.868 -1.969 . . . . 64.0 112.382 173.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 15' ' ' ASN . . . -42.24 -27.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 114.084 1.142 . . . . 72.299999999999997 114.084 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -57.58 -42.33 82.9 Favored 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 109.313 -0.625 . . . . 71.0 109.313 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 71.3 t80 -59.04 -22.14 60.23 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.11 1.364 . . . . 72.010000000000005 111.315 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -59.15 -37.32 77.03 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.835 -0.432 . . . . 71.129999999999995 109.835 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.638 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 15.6 tt0 -71.3 -19.47 62.32 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.139 0.971 . . . . 71.5 110.774 177.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.547 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 5.4 tt -68.3 -21.71 64.76 Favored 'General case' 0 C--N 1.308 -1.229 0 O-C-N 121.478 -0.764 . . . . 75.120000000000005 109.801 173.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.497 HH21 ' HB3' ' A' ' 41' ' ' GLU . 2.5 mpt_? -80.86 -41.89 22.41 Favored 'General case' 0 CA--C 1.476 -1.885 0 O-C-N 121.688 -0.633 . . . . 73.439999999999998 109.802 -178.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.666 ' HG3' ' HG3' ' A' ' 27' ' ' ARG . 9.3 pt-20 -55.37 -40.77 71.73 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 124.549 1.156 . . . . 73.319999999999993 109.723 -174.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.666 ' HG3' ' HG3' ' A' ' 26' ' ' GLU . 91.0 mtt180 -87.69 -30.96 19.99 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.726 -0.67 . . . . 74.310000000000002 112.326 -178.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -66.41 -36.19 82.2 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.881 0.372 . . . . 65.219999999999999 110.402 178.497 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.482 HG23 ' O ' ' A' ' 34' ' ' LEU . 66.2 mt -60.17 -41.15 85.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.108 -0.496 . . . . 72.209999999999994 109.828 176.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -72.89 -39.08 66.69 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.174 -0.466 . . . . 72.010000000000005 110.42 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -47.1 -54.11 11.21 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.298 1.439 . . . . 74.219999999999999 112.108 -177.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.519 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 94.9 mt -106.95 10.48 30.46 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 119.197 -1.001 . . . . 75.200000000000003 112.836 177.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 58.37 42.64 21.11 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 122.28 1.038 . . . . 74.109999999999999 109.731 -177.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 37.1 mt -79.99 133.96 36.2 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 114.337 -1.301 . . . . 72.040000000000006 109.783 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -75.31 147.44 82.66 Favored Pre-proline 0 C--N 1.29 -1.989 0 N-CA-C 105.761 -1.94 . . . . 74.129999999999995 105.761 174.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -55.75 -28.99 69.52 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.792 1.662 . . . . 62.520000000000003 112.381 178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -76.76 -7.33 55.17 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-O 120.965 0.412 . . . . 71.129999999999995 110.864 176.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 -111.76 -2.43 15.29 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 107.927 -1.138 . . . . 53.229999999999997 107.927 178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.433 ' CD1' HD11 ' A' ' 80' ' ' LEU . 2.6 tm? -142.04 80.03 1.7 Allowed 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 122.377 1.084 . . . . 61.5 110.92 -176.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -117.33 166.35 12.39 Favored 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 105.42 -2.067 . . . . 74.409999999999997 105.42 172.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.598 ' HA ' ' HB2' ' A' ' 80' ' ' LEU 0.46 8.9 pt-20 -63.87 -11.72 30.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 118.437 2.755 . . . . 61.130000000000003 118.437 -171.788 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.57 -8.37 35.22 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 118.597 0.635 . . . . 73.030000000000001 109.461 -179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -67.24 126.97 30.91 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-N 115.336 -0.847 . . . . 65.200000000000003 111.28 -177.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.543 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 41.5 t-20 -75.3 117.89 17.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.342 -0.845 . . . . 70.400000000000006 110.222 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.514 ' HB3' HD12 ' A' ' 50' ' ' LEU . 86.9 mt -76.49 -25.05 53.85 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.473 1.286 . . . . 65.150000000000006 114.473 -174.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.438 HG12 ' CB ' ' A' ' 78' ' ' PRO . 37.0 mm -76.92 -33.1 20.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 109.07 -0.715 . . . . 71.319999999999993 109.07 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -78.65 -13.54 59.77 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.559 -0.746 . . . . 71.319999999999993 109.78 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.45 -29.33 28.13 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.684 -0.858 . . . . 60.229999999999997 108.684 175.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.94 30.48 2.31 Favored Glycine 0 N--CA 1.439 -1.145 0 N-CA-C 115.212 0.845 . . . . 31.010000000000002 115.212 174.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' A' ' 45' ' ' LEU . 52.1 mt -76.74 109.29 10.4 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 118.199 0.999 . . . . 74.430000000000007 110.609 175.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.401 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 2.9 p30 -70.7 167.55 18.45 Favored 'General case' 0 C--O 1.252 1.216 0 N-CA-C 109.223 -0.658 . . . . 71.239999999999995 109.223 174.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.473 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 15.6 m -68.47 -16.97 64.08 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.602 1.334 . . . . 74.310000000000002 114.602 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.615 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 51.4 mm -74.16 -43.79 50.55 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.539 0 N-CA-C 106.955 -1.498 . . . . 61.240000000000002 106.955 177.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -60.95 -40.11 92.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.788 -0.819 . . . . 61.439999999999998 108.788 178.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.579 ' HB3' HD11 ' A' ' 71' ' ' LEU . 43.3 mt -55.76 -50.55 70.1 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.948 -1.024 . . . . 55.020000000000003 111.124 175.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.5 ptp -79.53 -18.15 52.48 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.942 0.719 . . . . 64.120000000000005 112.942 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 94.4 mtt180 -59.61 -47.58 85.05 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 106.94 -1.504 . . . . 71.040000000000006 106.94 172.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -63.18 -36.71 84.52 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 113.929 -1.487 . . . . 74.040000000000006 113.102 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 60.2 tp -54.97 -36.31 65.22 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.433 0.635 . . . . 72.019999999999996 110.846 178.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -77.28 -30.17 54.17 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.745 -0.661 . . . . 73.030000000000001 110.82 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.482 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 69.2 t90 -71.81 -35.51 69.96 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.91 -0.586 . . . . 71.540000000000006 109.668 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -66.64 -50.69 62.13 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 122.034 0.921 . . . . 73.030000000000001 109.455 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.1 ttp180 -65.57 -13.64 59.43 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 114.408 -1.269 . . . . 75.109999999999999 111.372 -175.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 2.8 ttpm? -48.82 -44.69 39.57 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.948 1.699 . . . . 55.020000000000003 111.341 174.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -105.64 14.07 28.95 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 108.616 -0.883 . . . . 75.319999999999993 108.616 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 74.99 26.9 65.56 Favored Glycine 0 N--CA 1.42 -2.405 0 CA-C-N 114.95 -1.023 . . . . 63.240000000000002 111.845 -176.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -66.36 162.8 19.54 Favored 'General case' 0 CA--C 1.484 -1.57 0 CA-C-N 117.498 0.649 . . . . 73.120000000000005 110.537 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 63.9 mtm-85 -134.65 99.75 4.43 Favored 'General case' 0 C--N 1.283 -2.309 0 C-N-CA 118.715 -1.194 . . . . 64.099999999999994 113.446 -162.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 pp -161.41 157.29 24.96 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 115.571 -0.74 . . . . 72.200000000000003 109.981 175.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.2 p -104.88 142.89 33.94 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 108.326 -0.99 . . . . 74.409999999999997 108.326 175.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.588 HD12 HD12 ' A' ' 74' ' ' LEU . 23.5 tp -61.85 -24.98 67.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.477 0.656 . . . . 74.150000000000006 110.207 -178.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.73 -28.17 32.67 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 125.305 1.442 . . . . 73.239999999999995 110.265 175.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -86.52 -28.97 23.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.569 -0.741 . . . . 75.209999999999994 110.365 -177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.588 HD12 HD12 ' A' ' 71' ' ' LEU . 29.9 mt -75.48 -21.7 57.85 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.111 -0.95 . . . . 70.409999999999997 110.801 -177.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -78.87 -36.41 42.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.046 -0.524 . . . . 71.049999999999997 109.788 173.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.01 -46.27 75.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.583 -0.735 . . . . 65.510000000000005 110.847 -176.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.73 87.13 56.66 Favored Pre-proline 0 N--CA 1.43 -1.459 0 N-CA-C 109.028 -0.73 . . . . 60.340000000000003 109.028 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.543 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 34.6 Cg_endo -90.38 86.55 0.36 Allowed 'Trans proline' 0 N--CA 1.418 -2.922 0 C-N-CA 121.058 1.172 . . . . 74.299999999999997 112.951 -177.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.1 p -150.17 147.05 27.25 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 105.118 -2.178 . . . . 75.299999999999997 105.118 175.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.598 ' HB2' ' HA ' ' A' ' 41' ' ' GLU . 88.2 mt -50.93 -47.61 60.93 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 118.432 0.56 . . . . 71.409999999999997 111.193 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.53 -44.45 36.29 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 114.551 -1.204 . . . . 61.240000000000002 112.287 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.418 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.98 -44.28 69.76 Favored 'General case' 0 C--O 1.21 -1.009 0 N-CA-C 111.921 0.341 . . . . 72.25 111.921 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.457 ' CG ' HD22 ' A' ' 74' ' ' LEU . 3.9 m0 -63.25 -36.44 83.65 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 108.109 -1.071 . . . . 74.120000000000005 108.109 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.431 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . 8.4 t30 -65.57 -48.46 72.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.352 -1.295 . . . . 73.109999999999999 109.845 177.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -58.35 -42.89 87.91 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.007 -0.997 . . . . 63.020000000000003 110.286 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 91.0 mt -65.99 -29.17 69.51 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.69 0.996 . . . . 64.319999999999993 113.69 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.602 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 7.6 ptp -82.25 -37.2 26.29 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 118.833 -1.147 . . . . 74.439999999999998 110.371 174.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.439 HD21 ' OXT' ' A' ' 93' ' ' GLU . 3.0 tm? -69.55 -39.64 77.3 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.627 -0.715 . . . . 71.409999999999997 110.861 -177.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.5 m -75.18 19.19 0.17 Allowed 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.566 0.58 . . . . 71.349999999999994 112.566 -177.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 68' ' ' ARG . 24.3 mmt180 -128.78 -1.45 5.37 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 107.425 -1.324 . . . . 75.400000000000006 107.425 175.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.427 ' HB3' ' HD2' ' A' ' 92' ' ' PRO . 15.7 m -136.49 174.63 4.26 Favored Pre-proline 0 N--CA 1.437 -1.101 0 N-CA-C 108.385 -0.969 . . . . 74.239999999999995 108.385 -170.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 91' ' ' SER . 30.4 Cg_endo -67.59 159.32 53.08 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 120.962 1.108 . . . . 73.430000000000007 109.962 170.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.634 ' OXT' ' HB2' ' A' ' 16' ' ' ARG . 43.4 mt-10 . . . . . 0 C--N 1.314 -0.947 0 O-C-N 123.809 0.693 . . . . 74.239999999999995 112.294 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.605 ' HB3' ' OXT' ' A' ' 93' ' ' GLU . 2.2 m-20 . . . . . 0 CA--C 1.488 -1.437 0 CA-C-O 118.275 -0.869 . . . . 41.049999999999997 109.642 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.438 ' H ' ' C ' ' A' ' 93' ' ' GLU . 18.4 t-20 72.83 80.46 0.14 Allowed 'General case' 0 N--CA 1.476 0.872 0 O-C-N 125.191 1.557 . . . . 54.350000000000001 107.516 -172.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.583 ' HD2' ' O ' ' A' ' 93' ' ' GLU . 1.5 mpt_? -86.18 -71.07 0.56 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 114.522 1.305 . . . . 71.319999999999993 114.522 -169.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.597 ' H ' HD11 ' A' ' 88' ' ' LEU . 47.2 m170 -54.1 -37.01 63.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.009 0.923 . . . . 74.019999999999996 112.701 -173.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.467 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -65.27 -14.99 62.01 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 113.854 1.057 . . . . 63.049999999999997 113.854 -176.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.54 -32.68 63.15 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.847 -0.533 . . . . 63.25 110.887 174.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.436 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 28.3 t70 -70.01 -36.87 75.44 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 108.627 -0.879 . . . . 71.349999999999994 108.627 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.543 ' CE1' HD22 ' A' ' 24' ' ' LEU . 75.4 t80 -59.7 -22.53 62.11 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.778 -1.101 . . . . 72.329999999999998 111.139 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 mm-40 -68.16 -22.48 64.84 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.425 -0.51 . . . . 75.430000000000007 110.404 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 23.6 tp60 -72.95 -34.79 66.75 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.587 -0.894 . . . . 73.230000000000004 108.587 172.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.543 HD22 ' CE1' ' A' ' 21' ' ' TYR . 5.5 tt -70.31 -33.61 71.74 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.599 -0.889 . . . . 72.329999999999998 108.599 175.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HD2' HD13 ' A' ' 80' ' ' LEU . 3.2 tpp180 -63.25 -49.02 75.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.011 -0.737 . . . . 63.140000000000001 109.011 178.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.508 ' OE1' ' HD2' ' A' ' 27' ' ' ARG . 4.2 tm-20 -53.34 -49.76 66.42 Favored 'General case' 0 CA--C 1.509 -0.599 0 O-C-N 124.438 1.086 . . . . 74.040000000000006 108.302 175.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.508 ' HD2' ' OE1' ' A' ' 26' ' ' GLU . 12.1 mmm180 -56.63 -50.99 70.41 Favored 'General case' 0 C--O 1.189 -2.13 0 CA-C-N 115.323 -0.853 . . . . 72.319999999999993 111.507 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.453 HD23 ' HA ' ' A' ' 28' ' ' LEU . 28.8 mt -50.68 -41.31 55.57 Favored 'General case' 0 C--O 1.245 0.826 0 N-CA-C 114.649 1.351 . . . . 73.030000000000001 114.649 -176.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.425 HG23 ' O ' ' A' ' 34' ' ' LEU . 60.1 mt -62.96 -48.97 85.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 O-C-N 123.605 0.566 . . . . 62.240000000000002 109.681 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -72.15 -44.54 62.94 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 112.842 0.682 . . . . 74.099999999999994 112.842 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -56.0 -53.12 60.81 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 123.939 0.896 . . . . 74.420000000000002 113.417 -176.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.466 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 96.5 mt -100.58 7.36 44.08 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 118.757 -1.177 . . . . 61.140000000000001 112.641 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 62.15 38.33 13.78 Favored 'General case' 0 N--CA 1.494 1.761 0 CA-C-O 121.842 0.83 . . . . 74.439999999999998 109.936 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.466 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 54.6 mt -80.49 130.62 35.26 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 114.923 -1.035 . . . . 75.540000000000006 108.252 -177.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.0 p -76.24 162.93 69.43 Favored Pre-proline 0 C--N 1.299 -1.597 0 N-CA-C 108.693 -0.854 . . . . 75.129999999999995 108.693 177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -63.03 -14.68 43.05 Favored 'Trans proline' 0 N--CA 1.487 1.141 0 C-N-CA 121.781 1.654 . . . . 72.319999999999993 113.151 -178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -98.22 0.49 45.89 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 121.644 0.735 . . . . 73.230000000000004 109.369 177.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -114.87 -8.69 12.54 Favored 'General case' 0 N--CA 1.431 -1.38 0 N-CA-C 107.538 -1.282 . . . . 71.329999999999998 107.538 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.474 HD13 HD11 ' A' ' 80' ' ' LEU . 2.2 tm? -143.12 76.18 1.51 Allowed 'General case' 0 N--CA 1.416 -2.128 0 CA-C-O 122.251 1.024 . . . . 74.150000000000006 109.62 -178.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -117.44 165.67 13.24 Favored 'General case' 0 C--N 1.283 -2.289 0 N-CA-C 106.517 -1.66 . . . . 64.019999999999996 106.517 173.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.36 -33.23 5.62 Favored 'General case' 0 CA--C 1.569 1.71 0 C-N-CA 125.039 1.335 . . . . 62.119999999999997 113.703 -173.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -1.88 37.8 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.91 -0.494 . . . . 75.299999999999997 111.401 -174.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -69.6 129.57 40.02 Favored 'General case' 0 C--O 1.251 1.152 0 CA-C-O 121.37 0.605 . . . . 63.350000000000001 112.112 -174.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.528 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 46.3 t-20 -74.24 112.33 10.29 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.359 -0.837 . . . . 64.329999999999998 109.689 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.1 mt -70.76 -26.18 63.24 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 114.469 1.285 . . . . 75.030000000000001 114.469 -176.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.4 HG12 ' HB3' ' A' ' 78' ' ' PRO . 46.7 mm -72.77 -33.75 44.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 N-CA-C 108.657 -0.868 . . . . 61.020000000000003 108.657 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -81.02 -12.13 59.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.465 -0.789 . . . . 73.219999999999999 109.971 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.86 -7.94 59.32 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 109.032 -0.729 . . . . 72.349999999999994 109.032 176.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.9 37.06 6.15 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.939 -1.028 . . . . 60.200000000000003 113.245 176.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.78 103.64 16.16 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 108.219 -1.03 . . . . 65.420000000000002 108.219 178.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.479 ' OD1' ' HB2' ' A' ' 54' ' ' ARG . 3.9 p-10 -66.07 166.19 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.255 -0.884 . . . . 70.040000000000006 109.546 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -77.19 -14.74 59.73 Favored 'General case' 0 N--CA 1.424 -1.731 0 N-CA-C 114.401 1.26 . . . . 54.229999999999997 114.401 -174.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.627 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 46.2 mm -83.93 -36.96 12.69 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.35 0 N-CA-C 106.819 -1.549 . . . . 72.349999999999994 106.819 175.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HB2' ' OD1' ' A' ' 51' ' ' ASP . 1.7 tpt85 -55.92 -45.73 78.66 Favored 'General case' 0 C--O 1.226 -0.136 0 N-CA-C 106.936 -1.505 . . . . 75.5 106.936 174.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.17 -46.71 89.38 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 113.51 -1.677 . . . . 74.450000000000003 110.057 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 47.9 ttm -74.86 -25.33 58.9 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.217 -0.447 . . . . 70.219999999999999 112.016 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 37.0 mmt180 -64.29 -36.41 84.03 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 109.242 -0.651 . . . . 75.219999999999999 109.242 176.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -65.19 -29.61 70.45 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.998 -1.001 . . . . 61.219999999999999 112.148 179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 49.2 tp -59.91 -27.1 66.46 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.403 0.62 . . . . 71.439999999999998 110.594 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -81.15 -40.73 23.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.032 -0.729 . . . . 74.109999999999999 109.032 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.528 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 24.4 t90 -63.29 -41.15 98.96 Favored 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 115.305 -0.862 . . . . 75.049999999999997 110.404 -177.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.455 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 61.5 m-85 -61.21 -51.2 70.0 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.813 0.816 . . . . 75.230000000000004 111.106 177.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.0 mtm180 -68.55 -13.23 62.19 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.256 -0.883 . . . . 72.530000000000001 113.221 -173.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 21.4 ttpp -44.9 -48.22 11.23 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.68 1.592 . . . . 74.5 112.5 173.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.417 ' HB2' ' CE2' ' A' ' 67' ' ' TYR . 6.5 m-20 -96.77 12.47 31.92 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.039 0.447 . . . . 72.109999999999999 110.397 -178.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 82.57 17.19 69.02 Favored Glycine 0 N--CA 1.421 -2.361 0 C-N-CA 120.24 -0.981 . . . . 22.010000000000002 111.486 -176.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.549 ' CE1' ' HB3' ' A' ' 17' ' ' HIS . 27.7 m-85 -66.62 165.16 15.29 Favored 'General case' 0 CA--C 1.485 -1.523 0 CA-C-O 121.444 0.64 . . . . 70.420000000000002 111.314 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -136.54 103.45 5.25 Favored 'General case' 0 C--N 1.282 -2.369 0 C-N-CA 119.613 -0.835 . . . . 71.239999999999995 111.363 -164.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.422 HD11 ' CD2' ' A' ' 62' ' ' PHE . 3.9 pp -159.64 152.34 21.49 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.537 0.523 . . . . 64.129999999999995 110.918 171.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -96.98 146.62 24.8 Favored 'General case' 0 N--CA 1.406 -2.651 0 N-CA-C 105.882 -1.896 . . . . 71.209999999999994 105.882 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.509 HD12 HD12 ' A' ' 74' ' ' LEU . 17.0 tp -72.65 -25.31 61.23 Favored 'General case' 0 C--N 1.291 -1.97 0 C-N-CA 120.057 -0.657 . . . . 75.239999999999995 110.471 -175.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 30.1 tpt85 -62.89 -19.98 64.71 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.087 -0.506 . . . . 71.400000000000006 110.413 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.58 -31.58 57.6 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.618 0.723 . . . . 71.030000000000001 109.194 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.509 HD12 HD12 ' A' ' 71' ' ' LEU . 18.0 mt -75.05 -22.52 58.34 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.339 -0.846 . . . . 75.450000000000003 109.485 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -87.76 -2.02 58.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.613 -0.721 . . . . 73.219999999999999 110.128 174.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.29 -51.52 5.26 Favored 'General case' 0 CA--C 1.503 -0.838 0 N-CA-C 108.751 -0.833 . . . . 71.109999999999999 108.751 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.39 87.45 56.22 Favored Pre-proline 0 N--CA 1.43 -1.459 0 N-CA-C 107.78 -1.193 . . . . 53.219999999999999 107.78 174.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.528 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 1.7 Cg_endo -81.16 86.75 1.57 Allowed 'Trans proline' 0 N--CA 1.43 -2.211 0 C-N-CA 121.146 1.231 . . . . 73.420000000000002 112.371 -175.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.2 p -153.23 153.38 32.59 Favored 'General case' 0 C--N 1.295 -1.77 0 N-CA-C 105.857 -1.905 . . . . 52.340000000000003 105.857 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.552 HD13 ' HD2' ' A' ' 25' ' ' ARG . 37.9 mt -50.47 -50.79 51.49 Favored 'General case' 0 C--N 1.317 -0.829 0 O-C-N 123.832 0.708 . . . . 74.129999999999995 111.822 178.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -44.65 -43.7 8.46 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 113.854 -1.521 . . . . 71.25 113.225 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -65.14 -48.7 72.63 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 120.985 -0.286 . . . . 74.120000000000005 111.283 -178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.439 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.9 OUTLIER -65.16 -35.43 81.06 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 108.124 -1.065 . . . . 74.439999999999998 108.124 -175.715 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -64.86 -53.73 42.02 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 114.655 -1.157 . . . . 75.409999999999997 109.436 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -70.27 -25.31 63.29 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 113.005 0.742 . . . . 55.240000000000002 113.005 -177.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 88.8 mt -62.21 -19.15 62.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.721 0.637 . . . . 72.25 112.721 179.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.426 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 59.0 mtt -74.97 -35.56 62.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.006 0.431 . . . . 64.109999999999999 110.007 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.597 HD11 ' H ' ' A' ' 17' ' ' HIS . 2.9 mm? -92.81 -14.05 28.32 Favored 'General case' 0 C--O 1.195 -1.779 0 N-CA-C 113.576 0.954 . . . . 74.010000000000005 113.576 178.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -74.68 22.35 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 CA-C-O 121.431 0.634 . . . . 72.299999999999997 111.811 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.438 ' H ' ' C ' ' A' ' 88' ' ' LEU . 22.7 mmt180 -132.02 2.01 3.95 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.486 -1.301 . . . . 64.109999999999999 107.486 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.407 ' HB3' ' CD ' ' A' ' 92' ' ' PRO . 49.0 m -159.8 -169.22 0.22 Allowed Pre-proline 0 CA--C 1.56 1.358 0 N-CA-C 107.234 -1.395 . . . . 64.5 107.234 -172.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.407 ' CD ' ' HB3' ' A' ' 91' ' ' SER . 13.7 Cg_exo -75.08 161.47 38.47 Favored 'Trans proline' 0 C--N 1.365 1.427 0 CA-C-N 121.125 1.437 . . . . 72.150000000000006 110.617 169.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.605 ' OXT' ' HB3' ' A' ' 14' ' ' ASP . 10.9 tp10 . . . . . 0 N--CA 1.473 0.691 0 C-N-CA 125.041 1.336 . . . . 73.109999999999999 110.473 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 . . . . . 0 N--CA 1.477 0.9 0 N-CA-C 108.817 -0.809 . . . . 63.219999999999999 108.817 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.644 ' HB2' ' HB3' ' A' ' 18' ' ' ALA . 6.5 p30 -94.94 164.0 13.09 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 123.578 0.751 . . . . 73.540000000000006 109.02 175.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.622 ' NE ' ' HB2' ' A' ' 93' ' ' GLU . 83.6 mtm180 -110.08 -79.71 0.58 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 119.354 -0.938 . . . . 62.039999999999999 112.954 -173.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 66.2 t-80 -81.62 -33.87 31.22 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 103.898 -2.631 . . . . 73.030000000000001 103.898 168.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.644 ' HB3' ' HB2' ' A' ' 15' ' ' ASN . . . -45.31 -14.45 0.02 OUTLIER 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 110.878 -2.874 . . . . 72.150000000000006 114.134 174.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -45.54 -22.07 0.14 Allowed 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.968 0.907 . . . . 70.010000000000005 112.466 174.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.522 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 23.8 t70 -54.31 -42.07 69.69 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.32 -0.622 . . . . 73.219999999999999 109.32 170.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.529 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 69.1 t80 -60.27 -22.65 63.36 Favored 'General case' 0 C--O 1.213 -0.854 0 C-N-CA 124.147 0.979 . . . . 73.319999999999993 110.466 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -60.44 -29.02 68.74 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.069 0.462 . . . . 74.420000000000002 110.203 -179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 27' ' ' ARG . 41.5 mm-40 -82.04 -24.94 35.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.696 0.628 . . . . 74.25 112.696 175.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 61' ' ' TRP . 4.7 tt -73.35 -34.6 65.72 Favored 'General case' 0 C--O 1.208 -1.085 0 N-CA-C 107.062 -1.459 . . . . 55.340000000000003 107.062 173.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.47 HH21 ' CD ' ' A' ' 41' ' ' GLU . 5.1 tpt180 -57.48 -58.01 10.15 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.105 1.362 . . . . 73.430000000000007 109.389 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -58.28 -45.34 88.07 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.119 -0.946 . . . . 72.109999999999999 109.676 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -63.09 -45.93 89.76 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.011 -0.995 . . . . 73.030000000000001 110.555 -177.158 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.72 -44.74 86.18 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.488 0.715 . . . . 55.420000000000002 110.016 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.564 HG12 HD13 ' A' ' 39' ' ' LEU . 54.0 mt -63.89 -44.93 98.18 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.04 0 CA-C-N 115.17 -0.923 . . . . 74.129999999999995 111.124 178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -70.36 -36.01 73.9 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 113.602 0.964 . . . . 44.420000000000002 113.602 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.6 -42.25 99.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 116.241 1.941 . . . . 74.439999999999998 116.241 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.526 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 88.5 mt -95.51 17.69 14.19 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 118.366 -1.334 . . . . 74.430000000000007 111.348 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 60.56 37.89 19.21 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 122.969 1.366 . . . . 70.450000000000003 109.091 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.564 HD23 HE21 ' A' ' 38' ' ' GLN . 24.2 mt -88.45 164.66 15.37 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 114.287 -1.324 . . . . 74.010000000000005 108.433 -178.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.406 ' H ' ' HB3' ' A' ' 38' ' ' GLN . 20.8 p -135.44 164.6 42.46 Favored Pre-proline 0 C--N 1.283 -2.318 0 N-CA-C 105.4 -2.074 . . . . 54.109999999999999 105.4 176.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.56 -16.09 45.73 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 121.919 1.746 . . . . 73.099999999999994 112.383 177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -88.06 -28.83 21.1 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.274 -0.421 . . . . 64.129999999999995 110.271 177.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.564 HE21 HD23 ' A' ' 34' ' ' LEU . 27.8 tt0 -94.6 -19.31 20.58 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-O 121.406 0.622 . . . . 74.420000000000002 110.147 -178.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.564 HD13 HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -128.21 93.96 3.79 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 107.354 -1.351 . . . . 54.420000000000002 107.354 177.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.433 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 17.6 t-80 -97.98 147.76 24.16 Favored 'General case' 0 C--N 1.286 -2.188 0 N-CA-C 104.05 -2.574 . . . . 72.109999999999999 104.05 167.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.47 ' CD ' HH21 ' A' ' 25' ' ' ARG 0.362 8.9 pt-20 -78.63 5.72 10.4 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 118.91 2.93 . . . . 73.099999999999994 118.91 -166.463 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.433 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -94.52 -13.62 25.91 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 107.672 -1.232 . . . . 62.409999999999997 107.672 174.84 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.1 m -77.64 146.34 36.17 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 114.503 -1.226 . . . . 72.430000000000007 111.614 -178.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.603 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.7 t-20 -77.76 115.77 17.77 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.027 -0.988 . . . . 71.219999999999999 110.817 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.7 mt -64.43 -25.16 67.89 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.935 1.087 . . . . 72.0 113.935 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.5 mm -68.53 -32.65 56.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.834 -0.802 . . . . 74.120000000000005 108.834 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -80.5 -10.89 59.73 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.136 -0.938 . . . . 70.400000000000006 110.221 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -89.0 -5.44 57.95 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.748 -0.834 . . . . 73.120000000000005 108.748 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.01 31.91 10.45 Favored Glycine 0 N--CA 1.431 -1.667 0 CA-C-N 114.953 -1.021 . . . . 51.030000000000001 113.695 176.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.5 tp -76.7 102.07 6.04 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.131 -1.063 . . . . 62.140000000000001 108.131 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.552 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 4.2 p30 -59.3 153.48 18.66 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.75 -1.113 . . . . 75.239999999999995 109.784 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' ' 56' ' ' MET . 32.3 m -71.8 -14.73 62.06 Favored 'General case' 0 N--CA 1.419 -1.978 0 N-CA-C 113.674 0.99 . . . . 73.209999999999994 113.674 -175.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.673 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 46.4 mm -75.01 -43.81 44.92 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.27 0 C-N-CA 118.199 -1.401 . . . . 64.310000000000002 107.329 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.552 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 0.2 OUTLIER -50.62 -50.01 55.32 Favored 'General case' 0 CA--C 1.496 -1.127 0 N-CA-C 108.049 -1.093 . . . . 72.5 108.049 175.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.513 ' HG ' HD11 ' A' ' 71' ' ' LEU . 9.7 tp -56.78 -52.53 64.68 Favored 'General case' 0 N--CA 1.435 -1.214 0 CA-C-N 112.989 -1.914 . . . . 72.010000000000005 111.282 -178.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' A' ' 52' ' ' SER . 20.4 ptp -79.97 -18.9 49.17 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 113.951 1.093 . . . . 63.420000000000002 113.951 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.673 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 60.6 mtm180 -64.99 -42.6 94.37 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 106.327 -1.731 . . . . 71.219999999999999 106.327 172.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.519 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 6.1 m95 -56.93 -37.78 71.98 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 113.835 -1.53 . . . . 74.019999999999996 112.416 -178.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -54.7 -37.33 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.725 0.774 . . . . 71.099999999999994 109.862 178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -81.03 -29.33 35.13 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.507 -0.769 . . . . 72.120000000000005 110.635 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.626 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 33.8 t90 -69.25 -36.98 77.71 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.886 -0.783 . . . . 74.239999999999995 108.886 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.478 ' HD1' ' HE2' ' A' ' 87' ' ' MET . 59.8 m-85 -62.42 -50.29 72.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.518 1.152 . . . . 63.539999999999999 109.4 173.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -65.82 -12.65 55.89 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.699 -1.591 . . . . 75.310000000000002 113.9 -171.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.626 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 29.4 mtmm -48.35 -50.82 29.03 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-O 121.556 0.693 . . . . 73.420000000000002 110.599 178.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -100.88 17.59 21.77 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 114.861 -1.063 . . . . 65.310000000000002 108.982 -173.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.44 33.68 52.28 Favored Glycine 0 N--CA 1.419 -2.473 0 CA-C-N 114.899 -1.046 . . . . 73.230000000000004 112.804 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -71.12 166.15 22.05 Favored 'General case' 0 CA--C 1.478 -1.807 0 C-N-CA 118.996 -1.082 . . . . 74.099999999999994 111.107 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -138.81 106.58 5.64 Favored 'General case' 0 C--N 1.277 -2.581 0 CA-C-N 115.139 -0.937 . . . . 73.120000000000005 112.076 -165.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.463 HD21 ' CE1' ' A' ' 62' ' ' PHE . 3.1 pp -167.67 157.46 10.35 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 124.385 1.053 . . . . 74.540000000000006 108.828 170.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 74.1 p -102.73 146.11 28.72 Favored 'General case' 0 N--CA 1.414 -2.262 0 N-CA-C 108.498 -0.927 . . . . 62.0 108.498 176.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.551 HD12 HD12 ' A' ' 74' ' ' LEU . 18.7 tp -63.61 -24.27 67.73 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.504 0.669 . . . . 51.310000000000002 109.425 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 ttp180 -47.97 -35.49 10.89 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.212 1.405 . . . . 75.230000000000004 110.081 172.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -82.6 -28.71 30.67 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.106 -0.952 . . . . 73.439999999999998 110.384 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.551 HD12 HD12 ' A' ' 71' ' ' LEU . 19.5 mt -80.0 -18.78 49.38 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.093 -0.958 . . . . 73.230000000000004 109.972 -179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -85.84 -36.1 20.22 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.058 -0.519 . . . . 73.040000000000006 110.092 171.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.74 -46.73 74.49 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.941 -0.572 . . . . 52.130000000000003 110.637 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -130.6 82.01 66.1 Favored Pre-proline 0 N--CA 1.432 -1.343 0 N-CA-C 109.233 -0.655 . . . . 75.049999999999997 109.233 176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.603 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 1.1 Cg_endo -82.99 86.09 1.5 Allowed 'Trans proline' 0 N--CA 1.429 -2.32 0 C-N-CA 121.177 1.252 . . . . 71.439999999999998 111.294 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 23.2 p -143.48 136.74 27.97 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 106.157 -1.794 . . . . 70.409999999999997 106.157 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.44 ' HB3' ' CB ' ' A' ' 41' ' ' GLU . 38.2 tp -51.35 -41.09 60.37 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 123.263 0.625 . . . . 75.040000000000006 111.177 -176.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.63 -33.49 75.73 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.17 -0.923 . . . . 74.219999999999999 111.741 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.38 -47.8 66.41 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-O 119.418 -0.325 . . . . 53.329999999999998 111.517 -177.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.45 ' CG ' HD22 ' A' ' 74' ' ' LEU . 1.0 OUTLIER -61.79 -39.1 90.49 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 108.219 -1.03 . . . . 72.439999999999998 108.219 -176.052 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -61.54 -51.68 67.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.131 -1.395 . . . . 61.299999999999997 109.9 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.55 -27.1 64.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.751 -0.659 . . . . 73.329999999999998 111.816 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 78.1 mt -62.76 -33.6 75.49 Favored 'General case' 0 C--O 1.215 -0.718 0 N-CA-C 111.952 0.352 . . . . 73.420000000000002 111.952 177.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.529 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 51.4 mtt -59.15 -49.25 78.59 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.382 -0.527 . . . . 71.540000000000006 109.61 174.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.585 ' HA ' ' OE2' ' A' ' 93' ' ' GLU . 10.1 mp -64.8 -32.04 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.459 -0.791 . . . . 74.230000000000004 111.962 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.9 m -83.94 1.35 43.91 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.951 -0.568 . . . . 71.019999999999996 112.103 -177.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 43.0 mmt-85 -133.17 14.81 4.2 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.375 -0.602 . . . . 74.140000000000001 109.375 178.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.421 ' HA ' ' HD3' ' A' ' 92' ' ' PRO . 17.4 m -145.41 141.51 17.09 Favored Pre-proline 0 N--CA 1.446 -0.63 0 N-CA-C 111.802 0.297 . . . . 72.400000000000006 111.802 -176.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 91' ' ' SER . 2.4 Cg_endo -87.07 118.18 1.39 Allowed 'Trans proline' 0 N--CA 1.443 -1.464 0 C-N-CA 121.897 1.731 . . . . 71.129999999999995 108.228 167.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.622 ' HB2' ' NE ' ' A' ' 16' ' ' ARG . 18.9 mt-10 . . . . . 0 C--O 1.263 1.814 0 N-CA-C 106.525 -1.657 . . . . 73.540000000000006 106.525 -177.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.406 ' OD1' ' HG ' ' A' ' 88' ' ' LEU . 29.9 t70 . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 108.707 -0.849 . . . . 74.400000000000006 108.707 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -169.12 85.3 0.15 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.535 0.522 . . . . 62.310000000000002 110.771 178.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.371 0.1 OUTLIER -110.26 -68.89 0.9 Allowed 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 117.702 -1.599 . . . . 73.150000000000006 112.545 170.575 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.41 ' CE1' ' HA ' ' A' ' 93' ' ' GLU . 40.5 m170 -77.72 -20.88 52.76 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.786 -0.571 . . . . 71.150000000000006 112.522 178.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.17 -15.14 2.03 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.12 0.968 . . . . 31.199999999999999 113.308 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -49.86 -32.37 14.19 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.756 0.422 . . . . 63.229999999999997 111.002 172.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.477 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 16.2 t70 -58.76 -42.59 89.26 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.867 -0.79 . . . . 65.150000000000006 108.867 175.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.725 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 64.8 t80 -61.31 -21.1 63.67 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.434 1.093 . . . . 72.129999999999995 111.732 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 8.3 tt0 -62.12 -38.61 89.56 Favored 'General case' 0 C--O 1.193 -1.896 0 N-CA-C 108.494 -0.928 . . . . 70.209999999999994 108.494 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.45 ' HA ' ' HG2' ' A' ' 26' ' ' GLU . 6.8 tp-100 -64.24 -21.45 66.59 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.868 0.842 . . . . 64.150000000000006 109.994 179.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.615 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 7.4 tt -77.51 -24.5 50.05 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 116.02 -0.536 . . . . 74.209999999999994 109.615 175.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.484 HH21 ' CD ' ' A' ' 41' ' ' GLU . 5.0 mpt_? -73.41 -50.77 20.06 Favored 'General case' 0 CA--C 1.47 -2.099 0 N-CA-C 107.937 -1.135 . . . . 74.549999999999997 107.937 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 1.6 mm-40 -47.3 -46.75 25.37 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 125.774 1.921 . . . . 71.109999999999999 109.768 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -83.61 -31.8 26.06 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-N 115.858 -0.61 . . . . 62.530000000000001 112.018 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.615 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -58.14 -41.12 83.03 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 109.707 -0.479 . . . . 74.239999999999995 109.707 179.448 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 25' ' ' ARG . 73.7 mt -61.79 -32.71 54.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 115.126 -0.943 . . . . 71.549999999999997 110.058 178.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -80.01 -46.24 16.97 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.005 -0.543 . . . . 70.109999999999999 111.463 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -49.58 -53.54 23.25 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.359 1.244 . . . . 40.439999999999998 114.359 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 50' ' ' LEU . 85.0 mt -98.25 5.22 48.58 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 118.359 -1.336 . . . . 74.510000000000005 111.667 178.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.1 t30 54.35 72.44 0.46 Allowed 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.252 1.025 . . . . 60.140000000000001 109.138 -173.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.0 mt -107.84 150.03 27.53 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.655 -1.157 . . . . 75.150000000000006 109.583 -173.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.2 p -88.81 159.87 45.12 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 107.726 -1.213 . . . . 73.439999999999998 107.726 174.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -67.33 -4.8 12.46 Favored 'Trans proline' 0 N--CA 1.492 1.416 0 C-N-CA 122.169 1.913 . . . . 73.519999999999996 113.722 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.718 HE21 ' HA ' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -97.95 -28.34 13.85 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.297 -1.001 . . . . 75.230000000000004 108.297 174.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -80.29 -37.61 32.4 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 114.9 -1.046 . . . . 70.400000000000006 108.62 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -104.97 85.78 2.34 Favored 'General case' 0 N--CA 1.412 -2.33 0 N-CA-C 106.86 -1.533 . . . . 73.329999999999998 106.86 175.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.7 t-80 -125.2 160.48 29.07 Favored 'General case' 0 C--N 1.279 -2.461 0 N-CA-C 105.077 -2.194 . . . . 74.329999999999998 105.077 -178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.656 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 28.1 mm-40 -54.45 -48.09 72.14 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.507 0.67 . . . . 71.430000000000007 111.593 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -80.12 11.74 3.27 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 125.06 1.344 . . . . 75.319999999999993 112.665 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.43 ' O ' ' HA ' ' A' ' 79' ' ' THR . 32.3 t -92.61 140.43 29.55 Favored 'General case' 0 C--O 1.254 1.295 0 O-C-N 121.832 -0.543 . . . . 52.329999999999998 110.402 -179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.545 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 41.3 t-20 -85.05 108.8 17.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.631 0.729 . . . . 65.129999999999995 109.998 -178.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.5 mt -68.24 -23.04 64.74 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 114.917 1.451 . . . . 74.329999999999998 114.917 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.3 mm -77.8 -32.28 17.75 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 N-CA-C 108.756 -0.831 . . . . 62.32 108.756 177.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -77.74 -23.73 49.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.689 -0.687 . . . . 75.310000000000002 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.49 -24.91 62.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.76 -0.654 . . . . 75.209999999999994 109.611 175.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.25 36.2 3.68 Favored Glycine 0 N--CA 1.436 -1.3 0 CA-C-N 115.61 -0.723 . . . . 44.100000000000001 114.331 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.49 HD21 HD21 ' A' ' 28' ' ' LEU . 26.4 mt -63.48 111.94 2.55 Favored 'General case' 0 CA--C 1.484 -1.58 0 CA-C-N 117.706 0.753 . . . . 72.030000000000001 112.385 175.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.56 139.93 24.28 Favored 'General case' 0 C--O 1.249 1.05 0 CA-C-N 113.8 -1.545 . . . . 64.140000000000001 108.608 170.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.6 m -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 116.409 -0.359 . . . . 75.510000000000005 111.858 -175.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.488 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 50.4 mm -71.32 -40.3 73.36 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.562 0 C-N-CA 118.529 -1.268 . . . . 63.549999999999997 108.743 174.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -59.12 -43.31 91.93 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.474 -0.565 . . . . 74.129999999999995 109.474 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.513 ' HG ' HD11 ' A' ' 71' ' ' LEU . 12.7 tp -57.76 -44.43 86.14 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.71 -1.132 . . . . 74.430000000000007 109.749 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.9 mtt -85.17 -18.27 34.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.925 -0.579 . . . . 53.350000000000001 112.423 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.673 ' NE ' ' HA ' ' A' ' 57' ' ' ARG . 4.4 mmp_? -74.3 -36.75 63.77 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 109.46 -0.57 . . . . 74.340000000000003 109.46 174.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 4.3 m95 -62.98 -37.97 89.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.354 -0.839 . . . . 65.530000000000001 111.475 176.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.12 -36.05 72.37 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.512 0.672 . . . . 73.239999999999995 110.592 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -77.52 -38.05 49.66 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.018 -0.992 . . . . 74.329999999999998 108.684 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.477 ' HH2' ' O ' ' A' ' 20' ' ' ASP . 71.7 t90 -59.49 -35.97 75.14 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 114.935 -1.029 . . . . 74.439999999999998 111.217 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.582 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 40.2 m-85 -64.61 -54.32 33.84 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.345 1.069 . . . . 73.409999999999997 108.82 176.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -65.22 -13.22 57.78 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.742 -1.572 . . . . 71.140000000000001 114.116 -171.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.7 pttm -54.43 -33.67 59.91 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.046 0.538 . . . . 75.239999999999995 110.804 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -108.48 14.84 24.37 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.288 -0.634 . . . . 54.439999999999998 109.288 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.09 24.25 64.38 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.432 -0.89 . . . . 54.329999999999998 111.816 -176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.582 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 3.2 m-85 -72.13 162.72 29.06 Favored 'General case' 0 CA--C 1.49 -1.356 0 CA-C-O 121.508 0.67 . . . . 71.349999999999994 111.816 177.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 mtm180 -133.13 98.07 4.17 Favored 'General case' 0 C--N 1.28 -2.421 0 CA-C-N 115.201 -0.909 . . . . 72.049999999999997 110.877 -165.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.0 mt -144.68 151.56 39.13 Favored 'General case' 0 C--O 1.257 1.494 0 CA-C-N 116.414 -0.357 . . . . 62.039999999999999 111.071 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.433 ' HB ' ' HG3' ' A' ' 73' ' ' GLU . 1.5 m -105.39 141.98 35.94 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 106.17 -1.789 . . . . 41.210000000000001 106.17 173.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.564 HD12 HD12 ' A' ' 74' ' ' LEU . 29.7 tp -79.54 -26.09 41.53 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 120.58 -0.448 . . . . 64.349999999999994 110.776 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -66.3 -16.95 64.45 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 116.213 -0.449 . . . . 73.209999999999994 110.519 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.433 ' HG3' ' HB ' ' A' ' 70' ' ' THR . 45.3 mt-10 -83.83 -28.16 28.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.393 -0.822 . . . . 74.239999999999995 109.339 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.564 HD12 HD12 ' A' ' 71' ' ' LEU . 33.7 mt -78.92 -17.53 55.37 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.593 -1.185 . . . . 62.130000000000003 110.081 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -83.94 -38.73 20.67 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.158 -0.682 . . . . 74.140000000000001 109.158 171.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.29 -48.09 82.99 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 115.439 -0.8 . . . . 61.130000000000003 110.549 -177.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -124.38 85.57 55.57 Favored Pre-proline 0 N--CA 1.428 -1.562 0 N-CA-C 108.034 -1.099 . . . . 75.239999999999995 108.034 173.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.545 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 37.3 Cg_endo -85.06 86.34 1.14 Allowed 'Trans proline' 0 N--CA 1.417 -2.996 0 C-N-CA 120.851 1.034 . . . . 45.329999999999998 111.74 -176.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' A' ' 43' ' ' SER . 2.7 p -150.97 142.05 23.09 Favored 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 107.338 -1.356 . . . . 71.120000000000005 107.338 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 41' ' ' GLU . 57.0 tp -53.33 -44.28 68.32 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 124.151 0.907 . . . . 74.010000000000005 110.996 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.656 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -55.37 -40.01 70.79 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.872 -1.058 . . . . 72.540000000000006 111.806 177.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.29 68.11 Favored 'General case' 0 C--O 1.205 -1.264 0 CA-C-N 115.93 -0.577 . . . . 71.319999999999993 111.426 -176.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.434 ' CG ' HD22 ' A' ' 74' ' ' LEU . 4.2 m0 -61.76 -40.02 93.68 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 107.826 -1.176 . . . . 74.430000000000007 107.826 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 21.5 t30 -57.95 -56.07 26.74 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 114.411 -1.268 . . . . 61.409999999999997 111.081 177.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -72.61 -25.12 61.2 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.423 0.527 . . . . 54.100000000000001 112.423 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.0 mt -65.09 -30.73 71.69 Favored 'General case' 0 C--O 1.207 -1.164 0 C-N-CA 121.205 -0.198 . . . . 61.399999999999999 110.674 173.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.725 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 29.6 mtt -57.91 -45.32 86.66 Favored 'General case' 0 C--O 1.194 -1.865 0 C-N-CA 120.3 -0.56 . . . . 73.239999999999995 110.58 173.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.406 ' HG ' ' OD1' ' A' ' 14' ' ' ASP . 2.1 mm? -75.8 -14.97 60.31 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 112.687 0.625 . . . . 71.349999999999994 112.687 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.1 p -108.72 0.3 20.45 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 112.395 0.517 . . . . 70.510000000000005 112.395 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 46.9 mmt-85 -127.9 -28.8 2.63 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.107 0.479 . . . . 72.129999999999995 110.643 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.6 m -118.07 78.55 13.37 Favored Pre-proline 0 C--N 1.304 -1.383 0 N-CA-C 109.56 -0.534 . . . . 71.140000000000001 109.56 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -82.71 116.54 2.56 Favored 'Trans proline' 0 N--CA 1.423 -2.623 0 N-CA-C 107.099 -1.923 . . . . 71.109999999999999 107.099 173.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.41 ' HA ' ' CE1' ' A' ' 17' ' ' HIS . 0.9 OUTLIER . . . . . 0 N--CA 1.44 -0.949 0 O-C-N 125.035 1.459 . . . . 64.040000000000006 111.335 -178.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 107.497 -1.297 . . . . 71.420000000000002 107.497 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -87.7 -174.75 4.9 Favored 'General case' 0 C--N 1.295 -1.768 0 N-CA-C 108.105 -1.072 . . . . 74.349999999999994 108.105 169.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.656 ' NH2' ' HA ' ' A' ' 93' ' ' GLU 0.335 0.0 OUTLIER -110.17 -75.51 0.62 Allowed 'General case' 0 CA--C 1.559 1.325 0 N-CA-C 115.839 1.792 . . . . 63.340000000000003 115.839 -173.766 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.595 ' HB2' ' OXT' ' A' ' 93' ' ' GLU . 4.4 t60 -69.03 -27.0 65.28 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-O 123.048 1.404 . . . . 63.039999999999999 107.867 177.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.5 -12.12 60.4 Favored 'General case' 0 C--O 1.181 -2.52 0 C-N-CA 127.722 2.409 . . . . 44.030000000000001 113.834 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -41.19 -25.06 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.241 0 N-CA-C 115.749 1.759 . . . . 62.350000000000001 115.749 -172.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.462 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 28.8 t70 -61.4 -35.85 78.66 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.951 -0.759 . . . . 73.230000000000004 108.951 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.611 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 78.8 t80 -60.51 -28.8 68.67 Favored 'General case' 0 CA--C 1.503 -0.829 0 C-N-CA 124.326 1.05 . . . . 62.350000000000001 110.567 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -61.34 -30.89 70.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 119.683 -0.807 . . . . 75.409999999999997 110.867 177.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 26.6 tp60 -70.62 -39.11 73.93 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.146 -1.057 . . . . 73.239999999999995 108.146 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.606 HD22 ' CE1' ' A' ' 21' ' ' TYR . 4.5 tt -64.83 -34.76 79.12 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.784 -0.45 . . . . 64.400000000000006 109.784 176.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.528 ' NH1' ' HB3' ' A' ' 80' ' ' LEU . 3.3 tpp180 -64.04 -48.49 76.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.004 -0.739 . . . . 72.129999999999995 109.004 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -55.18 -44.27 75.1 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 114.56 -1.2 . . . . 73.430000000000007 109.42 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 3.3 mmp_? -61.6 -56.23 22.1 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.136 -0.938 . . . . 73.109999999999999 111.28 176.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 28' ' ' LEU . 20.3 mt -51.66 -43.7 62.78 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.156 1.169 . . . . 74.129999999999995 114.156 -176.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.532 HG12 HD23 ' A' ' 39' ' ' LEU . 62.3 mt -66.65 -34.23 68.68 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.048 -0.524 . . . . 74.420000000000002 111.465 -177.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -84.03 -32.7 24.74 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.63 -0.428 . . . . 73.200000000000003 111.306 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -48.06 -53.65 15.72 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 113.162 0.801 . . . . 62.43 113.162 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.522 HD11 HD23 ' A' ' 50' ' ' LEU . 3.7 mp -107.75 11.51 28.22 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 119.097 -1.041 . . . . 73.200000000000003 111.778 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 57.01 46.54 19.17 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 122.231 1.015 . . . . 61.420000000000002 109.802 -176.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 60.6 mt -79.78 130.37 35.27 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 114.514 -1.221 . . . . 64.450000000000003 109.221 -175.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.8 m -75.25 148.7 84.03 Favored Pre-proline 0 C--N 1.289 -2.065 0 N-CA-C 107.017 -1.475 . . . . 61.32 107.017 176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -57.33 -21.08 42.61 Favored 'Trans proline' 0 N--CA 1.49 1.288 0 C-N-CA 121.815 1.677 . . . . 73.230000000000004 111.954 175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -85.24 -6.9 59.24 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.935 -0.575 . . . . 71.25 109.959 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.7 tp60 -104.89 -31.19 9.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 123.818 0.847 . . . . 63.439999999999998 108.725 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.532 HD23 HG12 ' A' ' 29' ' ' ILE . 21.1 tp -126.32 91.81 3.44 Favored 'General case' 0 N--CA 1.411 -2.416 0 CA-C-O 121.57 0.7 . . . . 51.130000000000003 111.758 -176.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.478 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 32.9 t-80 -115.24 166.77 11.48 Favored 'General case' 0 C--N 1.28 -2.419 0 N-CA-C 106.594 -1.632 . . . . 73.230000000000004 106.594 173.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 6.6 mm-40 -42.73 -40.32 2.76 Favored 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 114.668 1.358 . . . . 64.129999999999995 114.668 -178.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.478 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -89.57 -6.13 56.59 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.812 -0.555 . . . . 74.200000000000003 111.426 -173.133 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.7 m -72.96 127.19 31.83 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-O 121.126 0.489 . . . . 52.25 110.879 -175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.499 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 54.9 m-80 -73.33 119.06 17.05 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 121.679 0.752 . . . . 72.299999999999997 112.274 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 18.8 mt -69.84 -26.42 64.21 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.832 -1.077 . . . . 73.420000000000002 112.893 -178.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.478 HG12 ' CB ' ' A' ' 78' ' ' PRO . 43.9 mm -72.88 -29.07 28.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 109.075 -0.713 . . . . 72.200000000000003 109.075 175.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -78.18 -23.91 47.42 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 109.718 -0.475 . . . . 74.030000000000001 109.718 177.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.8 -34.31 69.28 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.653 -0.703 . . . . 33.350000000000001 109.17 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.43 37.03 1.37 Allowed Glycine 0 N--CA 1.438 -1.226 0 C-N-CA 120.588 -0.815 . . . . 42.549999999999997 114.045 175.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.522 HD23 HD11 ' A' ' 32' ' ' LEU . 50.6 mt -68.77 114.94 7.56 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 117.473 0.636 . . . . 64.109999999999999 109.965 175.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -71.8 157.01 38.66 Favored 'General case' 0 C--O 1.253 1.261 0 N-CA-C 107.653 -1.24 . . . . 75.329999999999998 107.653 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.9 m -67.23 -14.9 63.34 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 113.708 1.003 . . . . 55.25 113.708 -174.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.533 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 49.4 mm -79.27 -44.19 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.275 0 C-N-CA 118.42 -1.312 . . . . 64.129999999999995 107.948 177.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.419 ' HG2' ' NH2' ' A' ' 57' ' ' ARG . 41.7 mtt180 -59.38 -43.63 92.86 Favored 'General case' 0 CA--C 1.501 -0.929 0 N-CA-C 108.44 -0.948 . . . . 73.430000000000007 108.44 176.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.37 -46.23 86.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.449 -1.251 . . . . 74.150000000000006 109.869 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 36.9 ttm -81.58 -19.03 42.8 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 112.662 0.615 . . . . 75.439999999999998 112.662 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 78.6 mtt180 -59.29 -47.49 85.17 Favored 'General case' 0 C--N 1.349 0.574 0 N-CA-C 106.202 -1.777 . . . . 63.439999999999998 106.202 173.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.442 ' HA ' ' HB3' ' A' ' 61' ' ' TRP . 8.0 m95 -59.33 -36.48 75.74 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 112.883 -1.962 . . . . 75.25 113.395 -174.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -60.18 -43.06 96.15 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.302 0.572 . . . . 71.25 110.496 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -74.98 -34.64 62.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.57 -0.741 . . . . 73.430000000000007 109.368 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.571 ' CH2' ' HB2' ' A' ' 24' ' ' LEU . 68.9 t90 -61.67 -35.25 77.44 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.719 -1.128 . . . . 73.409999999999997 110.453 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.496 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 28.4 m-85 -68.16 -52.2 37.24 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.399 1.095 . . . . 74.540000000000006 109.606 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -69.24 -13.09 62.21 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.076 -1.42 . . . . 72.340000000000003 114.084 -172.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 24.7 pttm -57.8 -32.83 67.93 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.028 0.442 . . . . 72.420000000000002 109.93 175.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -108.3 14.94 24.49 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 108.896 -0.779 . . . . 74.239999999999995 108.896 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.14 35.58 83.68 Favored Glycine 0 N--CA 1.427 -1.945 0 CA-C-N 114.998 -1.001 . . . . 61.32 113.181 -179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.496 ' HB2' ' HB3' ' A' ' 62' ' ' PHE . 21.1 m-85 -67.49 162.97 22.06 Favored 'General case' 0 CA--C 1.498 -1.056 0 CA-C-N 117.927 0.863 . . . . 73.420000000000002 111.936 175.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -112.74 58.84 0.64 Allowed 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 115.009 -0.996 . . . . 73.0 111.68 -167.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.7 mt -130.0 149.28 51.79 Favored 'General case' 0 CA--C 1.497 -1.093 0 C-N-CA 120.587 -0.445 . . . . 65.030000000000001 111.306 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 m -118.04 148.09 42.59 Favored 'General case' 0 N--CA 1.412 -2.339 0 N-CA-C 106.427 -1.694 . . . . 75.209999999999994 106.427 170.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.589 HD12 HD12 ' A' ' 74' ' ' LEU . 20.4 tp -76.05 -24.34 55.13 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-O 120.81 0.338 . . . . 74.030000000000001 111.051 -173.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.26 -21.75 62.27 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 121.143 0.497 . . . . 71.239999999999995 110.015 178.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -80.78 -32.38 35.45 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.135 -0.939 . . . . 55.340000000000003 109.182 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.589 HD12 HD12 ' A' ' 71' ' ' LEU . 48.8 mt -82.54 -17.86 43.51 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.572 -1.194 . . . . 71.129999999999995 110.791 -175.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -78.11 -34.51 50.0 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 116.308 -0.405 . . . . 74.019999999999996 109.92 170.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -72.54 -43.53 63.37 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.729 -0.668 . . . . 74.340000000000003 110.472 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -128.79 88.85 50.77 Favored Pre-proline 0 N--CA 1.433 -1.296 0 N-CA-C 108.725 -0.842 . . . . 72.540000000000006 108.725 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.499 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 37.9 Cg_endo -96.74 85.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.423 -2.667 0 C-N-CA 121.259 1.306 . . . . 62.149999999999999 113.267 -176.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 22.6 p -146.14 154.99 42.42 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 105.318 -2.105 . . . . 75.420000000000002 105.318 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.528 ' HB3' ' NH1' ' A' ' 25' ' ' ARG . 26.8 mt -54.07 -44.35 71.06 Favored 'General case' 0 C--O 1.249 1.027 0 CA-C-N 118.842 0.746 . . . . 72.099999999999994 110.814 177.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.434 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -51.88 -46.87 64.66 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 114.388 -1.278 . . . . 63.520000000000003 111.927 -177.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.74 99.51 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 112.341 0.497 . . . . 74.010000000000005 112.341 -177.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.458 ' CD1' HD22 ' A' ' 74' ' ' LEU . 2.6 m0 -68.59 -37.89 80.21 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 108.309 -0.997 . . . . 65.340000000000003 108.309 -176.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -68.04 -51.81 42.58 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.824 -1.08 . . . . 71.310000000000002 109.973 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -60.88 -41.31 95.75 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.263 1.025 . . . . 74.209999999999994 111.646 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.82 -36.37 80.94 Favored 'General case' 0 C--O 1.199 -1.557 0 CA-C-N 116.756 -0.202 . . . . 64.430000000000007 111.169 177.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.611 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 45.4 mtt -62.2 -48.35 80.42 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 120.038 -0.665 . . . . 74.510000000000005 111.115 175.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.33 -24.33 66.51 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.0 0.741 . . . . 75.140000000000001 113.0 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.7 p -94.17 6.04 49.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.43 0.633 . . . . 75.109999999999999 111.484 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -129.52 16.67 5.94 Favored 'General case' 0 C--O 1.248 1.016 0 N-CA-C 109.01 -0.737 . . . . 72.200000000000003 109.01 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.2 m -146.33 148.33 34.16 Favored Pre-proline 0 N--CA 1.432 -1.365 0 N-CA-C 108.776 -0.824 . . . . 65.340000000000003 108.776 -178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.25 117.38 3.79 Favored 'Trans proline' 0 N--CA 1.439 -1.691 0 N-CA-C 108.327 -1.451 . . . . 63.240000000000002 108.327 170.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.656 ' HA ' ' NH2' ' A' ' 16' ' ' ARG . 15.5 mm-40 . . . . . 0 C--O 1.279 2.658 0 O-C-N 125.152 1.532 . . . . 71.129999999999995 113.765 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.551 ' OD1' ' HG3' ' A' ' 16' ' ' ARG . 20.5 t70 . . . . . 0 CA--C 1.499 -0.997 0 N-CA-C 108.494 -0.928 . . . . 50.140000000000001 108.494 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -157.47 22.27 0.29 Allowed 'General case' 0 C--N 1.312 -1.044 0 O-C-N 124.302 1.001 . . . . 42.240000000000002 109.542 176.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.551 ' HG3' ' OD1' ' A' ' 14' ' ' ASP 0.486 0.0 OUTLIER -46.69 -74.13 0.04 OUTLIER 'General case' 0 C--N 1.373 1.607 0 N-CA-C 117.436 2.384 . . . . 74.439999999999998 117.436 -173.565 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -78.35 -21.02 50.12 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 121.67 0.747 . . . . 71.230000000000004 111.85 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.45 ' HB2' HD13 ' A' ' 88' ' ' LEU . . . -62.5 -16.13 53.95 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.164 -0.926 . . . . 74.109999999999999 111.69 179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.34 -34.46 33.89 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 122.333 0.253 . . . . 42.43 110.968 173.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.611 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 24.2 t70 -61.82 -40.72 96.27 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.358 0.599 . . . . 74.299999999999997 109.493 176.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.584 ' CE1' HD22 ' A' ' 24' ' ' LEU . 53.6 t80 -66.1 -22.39 66.4 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.807 -1.088 . . . . 72.400000000000006 112.084 -177.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -65.45 -29.75 70.47 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.659 0.615 . . . . 73.319999999999993 112.659 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 10.0 pt20 -74.68 -19.54 60.22 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.642 -0.873 . . . . 75.329999999999998 108.642 178.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.584 HD22 ' CE1' ' A' ' 21' ' ' TYR . 5.2 tt -72.96 -38.95 66.56 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.85 -0.796 . . . . 74.239999999999995 108.85 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.439 HH21 ' HB3' ' A' ' 80' ' ' LEU . 1.6 mpt_? -58.44 -46.69 86.02 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 110.119 -0.326 . . . . 74.430000000000007 110.119 175.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -44.08 -52.89 6.84 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 125.168 1.542 . . . . 72.120000000000005 110.407 179.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -86.43 -32.02 21.09 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 115.207 -0.906 . . . . 72.140000000000001 113.141 -173.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.425 HD13 HD21 ' A' ' 80' ' ' LEU . 5.5 tt -59.55 -33.12 71.02 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 122.987 0.515 . . . . 55.340000000000003 110.269 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.455 HG12 HD23 ' A' ' 39' ' ' LEU . 77.4 mt -64.88 -33.29 62.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-N 115.647 -0.706 . . . . 72.049999999999997 111.493 178.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -81.81 -29.8 32.49 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 121.753 -0.592 . . . . 74.230000000000004 111.299 176.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.447 ' CD ' ' HE ' ' A' ' 54' ' ' ARG . 6.6 mm-40 -54.77 -54.11 46.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.268 0.84 . . . . 74.430000000000007 113.268 -177.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.467 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 4.7 mp -95.89 7.88 45.12 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.39 -0.524 . . . . 74.230000000000004 111.793 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.7 t30 57.83 65.78 1.25 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.835 1.302 . . . . 62.25 108.732 -173.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.467 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 49.6 mt -108.14 -176.11 2.96 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 113.986 -1.461 . . . . 64.310000000000002 108.281 -177.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.1 m -146.39 148.13 33.33 Favored Pre-proline 0 C--N 1.277 -2.562 0 N-CA-C 104.277 -2.49 . . . . 75.030000000000001 104.277 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -55.55 -28.61 65.74 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 C-N-CA 122.056 1.838 . . . . 74.129999999999995 112.633 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.2 mp0 -75.22 -12.19 60.24 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.014 0.435 . . . . 71.040000000000006 110.99 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.7 tp60 -102.09 -40.63 6.74 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.228 -0.656 . . . . 65.140000000000001 109.228 177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.493 HD21 HD11 ' A' ' 80' ' ' LEU . 51.2 tp -109.47 94.57 5.1 Favored 'General case' 0 N--CA 1.412 -2.361 0 CA-C-N 115.346 -0.843 . . . . 72.329999999999998 112.774 -173.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.6 t-80 -102.67 165.12 11.25 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 104.759 -2.312 . . . . 72.349999999999994 104.759 168.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.435 ' CD ' HH22 ' A' ' 25' ' ' ARG 0.378 12.0 pt-20 -76.45 -1.45 27.15 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 117.994 2.59 . . . . 72.239999999999995 117.994 -169.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.33 -9.41 35.98 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.936 -0.765 . . . . 64.099999999999994 108.936 178.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.1 m -68.77 132.92 47.61 Favored 'General case' 0 N--CA 1.425 -1.713 0 CA-C-N 114.851 -1.068 . . . . 72.319999999999993 111.287 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.574 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 39.8 t-20 -77.11 114.14 15.59 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.495 -0.775 . . . . 65.319999999999993 110.453 -178.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.496 HD11 HD23 ' A' ' 80' ' ' LEU . 86.9 mt -70.14 -29.85 66.87 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 114.157 1.169 . . . . 71.150000000000006 114.157 -175.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.415 HG12 ' CB ' ' A' ' 78' ' ' PRO . 39.8 mm -72.02 -34.05 49.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 C-N-CA 120.153 -0.619 . . . . 71.329999999999998 109.67 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -78.47 -13.38 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.871 -0.604 . . . . 70.120000000000005 110.38 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -88.48 -9.75 51.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.636 -0.711 . . . . 73.450000000000003 109.152 175.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 88.09 36.79 8.09 Favored Glycine 0 N--CA 1.437 -1.291 0 CA-C-N 115.306 -0.861 . . . . 60.210000000000001 113.775 177.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.0 106.1 9.64 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 108.032 -1.099 . . . . 60.140000000000001 108.032 176.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.604 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.6 p30 -63.2 157.18 23.2 Favored 'General case' 0 C--O 1.251 1.171 0 CA-C-N 114.501 -1.227 . . . . 73.420000000000002 111.383 -177.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -68.0 -14.38 62.92 Favored 'General case' 0 N--CA 1.423 -1.825 0 N-CA-C 113.561 0.949 . . . . 72.219999999999999 113.561 -177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.507 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.1 mm -80.36 -38.87 18.38 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.44 0 C-N-CA 117.964 -1.495 . . . . 74.319999999999993 107.921 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.604 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 2.1 mpt_? -57.08 -47.16 81.7 Favored 'General case' 0 CA--C 1.492 -1.264 0 N-CA-C 108.715 -0.846 . . . . 63.350000000000001 108.715 173.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' HG ' HD11 ' A' ' 71' ' ' LEU . 5.3 tp -59.13 -43.11 91.95 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 113.724 -1.58 . . . . 72.420000000000002 109.876 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.9 tpp -75.33 -33.86 61.17 Favored 'General case' 0 C--O 1.246 0.892 0 CA-C-N 116.207 -0.451 . . . . 62.32 110.964 -178.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.507 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 42.5 mtm180 -64.44 -43.0 95.67 Favored 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 109.312 -0.625 . . . . 74.120000000000005 109.312 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -65.03 -37.9 89.13 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.113 -0.949 . . . . 72.5 111.852 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 66.5 tp -54.64 -35.2 63.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.534 0.683 . . . . 75.230000000000004 111.284 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -81.43 -36.45 29.43 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.955 -0.566 . . . . 74.030000000000001 110.278 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.447 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 75.2 t90 -61.25 -40.57 94.56 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.557 -0.747 . . . . 72.0 110.788 178.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.512 ' CD1' HD11 ' A' ' 69' ' ' LEU . 52.7 m-85 -63.06 -53.35 55.06 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-O 122.098 0.951 . . . . 54.340000000000003 111.487 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -67.94 -12.69 61.22 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 114.542 -1.208 . . . . 73.340000000000003 113.607 -173.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 61' ' ' TRP . 23.3 pttm -54.58 -33.7 60.71 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.727 0.411 . . . . 75.120000000000005 110.722 177.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -108.32 10.68 27.6 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.574 -0.528 . . . . 73.439999999999998 109.574 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 78.38 33.89 38.02 Favored Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.8 -0.714 . . . . 71.530000000000001 112.687 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -74.47 146.84 42.46 Favored 'General case' 0 CA--C 1.485 -1.555 0 C-N-CA 119.527 -0.869 . . . . 71.140000000000001 112.155 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.42 HH21 ' HB3' ' A' ' 86' ' ' LEU . 0.1 OUTLIER -102.21 102.59 13.02 Favored 'General case' 0 N--CA 1.418 -2.054 0 CA-C-N 114.488 -1.233 . . . . 64.209999999999994 110.391 -170.503 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.512 HD11 ' CD1' ' A' ' 62' ' ' PHE . 3.9 pp -168.59 144.5 3.6 Favored 'General case' 0 C--N 1.313 -1.008 0 O-C-N 124.1 0.875 . . . . 72.200000000000003 111.22 167.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.4 p -100.42 146.91 26.44 Favored 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 106.029 -1.841 . . . . 62.409999999999997 106.029 169.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.528 HD12 HD12 ' A' ' 74' ' ' LEU . 13.9 tp -64.71 -24.54 67.6 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.334 0.587 . . . . 73.349999999999994 110.055 -177.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -48.53 -34.42 11.31 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 125.332 1.453 . . . . 51.229999999999997 110.249 173.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -82.49 -28.4 31.18 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.064 -0.971 . . . . 74.150000000000006 110.375 -175.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.528 HD12 HD12 ' A' ' 71' ' ' LEU . 23.2 mt -80.17 -20.08 45.63 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.183 -0.917 . . . . 71.230000000000004 110.432 -178.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -79.72 -34.14 40.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.065 -0.516 . . . . 74.519999999999996 109.839 171.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.76 -46.81 65.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.694 -0.684 . . . . 60.210000000000001 110.552 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.92 85.77 58.8 Favored Pre-proline 0 C--N 1.309 -1.152 0 N-CA-C 109.087 -0.709 . . . . 71.209999999999994 109.087 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.574 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 17.5 Cg_endo -89.45 86.9 0.43 Allowed 'Trans proline' 0 N--CA 1.422 -2.697 0 C-N-CA 121.245 1.297 . . . . 71.420000000000002 112.986 -176.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.5 p -149.75 144.29 25.96 Favored 'General case' 0 C--N 1.289 -2.025 0 N-CA-C 104.83 -2.285 . . . . 62.310000000000002 104.83 175.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 45' ' ' LEU . 67.0 mt -55.33 -39.46 70.02 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 118.743 0.701 . . . . 74.329999999999998 111.866 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -56.52 -40.12 74.49 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.164 -0.926 . . . . 72.510000000000005 111.976 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -68.13 -40.75 82.39 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 119.618 -0.23 . . . . 73.219999999999999 111.103 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.459 ' CD1' HD22 ' A' ' 74' ' ' LEU . 5.1 m0 -62.1 -45.23 94.41 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 107.477 -1.305 . . . . 74.120000000000005 107.477 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.426 ' O ' ' HG2' ' A' ' 87' ' ' MET . 28.9 t30 -56.56 -53.55 56.3 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 113.912 -1.495 . . . . 63.420000000000002 110.211 177.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -60.61 -48.01 83.68 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.604 -0.725 . . . . 75.239999999999995 112.442 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 92.7 mt -59.53 -35.21 73.76 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 112.786 0.662 . . . . 71.239999999999995 112.786 -177.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.426 ' HG2' ' O ' ' A' ' 84' ' ' ASN . 20.4 ptm -82.1 -45.05 15.74 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 120.513 -0.475 . . . . 63.149999999999999 110.411 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.533 HD11 ' HD2' ' A' ' 16' ' ' ARG . 18.8 tp -72.58 -13.53 61.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 113.734 1.012 . . . . 75.040000000000006 113.734 -176.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.9 m -63.56 -24.86 67.98 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.465 0.65 . . . . 73.239999999999995 110.247 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.464 ' HA ' ' NE ' ' A' ' 90' ' ' ARG . 0.2 OUTLIER -132.55 -59.07 0.92 Allowed 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 113.565 0.95 . . . . 74.310000000000002 113.565 176.355 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 40.7 m 54.92 -174.88 0.02 OUTLIER Pre-proline 0 CA--C 1.578 2.041 0 O-C-N 124.12 0.887 . . . . 55.399999999999999 110.393 -171.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -81.57 116.69 2.95 Favored 'Trans proline' 0 N--CA 1.446 -1.307 0 N-CA-C 107.239 -1.869 . . . . 74.120000000000005 107.239 169.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 . . . . . 0 N--CA 1.427 -1.581 0 N-CA-C 106.809 -1.552 . . . . 75.019999999999996 106.809 -172.026 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 CA--C 1.508 -0.669 0 N-CA-C 106.524 -1.658 . . . . 50.530000000000001 106.524 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -169.15 105.03 0.39 Allowed 'General case' 0 C--O 1.219 -0.523 0 O-C-N 123.463 0.477 . . . . 73.329999999999998 109.852 176.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.405 ' HD3' HD12 ' A' ' 88' ' ' LEU 0.339 0.0 OUTLIER -110.72 -69.19 0.88 Allowed 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 119.237 -0.985 . . . . 74.010000000000005 112.216 168.76 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.2 m-70 -78.65 -21.08 48.89 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.974 0.731 . . . . 73.310000000000002 112.974 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.05 -15.33 8.9 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 113.701 1.0 . . . . 45.210000000000001 113.701 -176.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -48.66 -30.2 5.22 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 122.974 0.51 . . . . 53.329999999999998 111.326 172.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.466 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 27.3 t70 -63.33 -43.55 97.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.1 -1.074 . . . . 71.329999999999998 108.1 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.603 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 82.6 t80 -66.58 -23.01 66.14 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.114 -0.948 . . . . 75.25 110.598 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -65.25 -34.03 77.4 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.986 -0.746 . . . . 62.310000000000002 108.986 176.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -73.45 -23.75 60.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.781 -0.645 . . . . 75.319999999999993 109.79 175.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HB2' ' CH2' ' A' ' 61' ' ' TRP . 4.3 tt -65.88 -26.66 67.73 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.722 -0.473 . . . . 75.010000000000005 109.722 173.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.607 ' NH2' ' HB3' ' A' ' 80' ' ' LEU . 2.2 mpt_? -64.81 -44.5 89.67 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 120.53 -0.468 . . . . 73.340000000000003 111.158 175.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -52.92 -51.13 62.4 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.202 0.939 . . . . 71.109999999999999 108.835 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.425 ' HA ' ' NE ' ' A' ' 27' ' ' ARG . 3.6 mmp_? -65.55 -44.04 88.06 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.124 -0.944 . . . . 73.519999999999996 111.522 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -62.49 -36.6 83.02 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.357 0.663 . . . . 73.5 111.913 -177.303 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 25' ' ' ARG . 82.9 mt -64.71 -32.88 59.86 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.983 0.421 . . . . 63.100000000000001 110.284 179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -84.1 -31.37 25.32 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 110.104 -0.332 . . . . 73.450000000000003 110.104 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.402 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 9.0 tp10 -50.36 -54.19 23.47 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.245 1.418 . . . . 62.329999999999998 112.423 -178.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 95.2 mt -103.54 3.36 34.62 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 119.585 -0.846 . . . . 72.120000000000005 111.567 176.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 t30 56.45 69.13 0.77 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.656 1.217 . . . . 72.299999999999997 108.241 -172.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 41.1 mt -99.14 141.78 31.47 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.12 -1.4 . . . . 74.450000000000003 110.75 -172.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.6 m -79.44 146.13 65.27 Favored Pre-proline 0 C--N 1.292 -1.934 0 N-CA-C 106.237 -1.764 . . . . 75.120000000000005 106.237 175.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.98 -22.01 52.79 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 121.903 1.735 . . . . 63.210000000000001 112.677 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -88.47 -2.08 58.4 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.332 0.587 . . . . 74.510000000000005 110.37 177.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -112.28 -14.01 13.39 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 108.111 -1.07 . . . . 42.329999999999998 108.111 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.466 ' CD1' HD11 ' A' ' 80' ' ' LEU . 2.6 tm? -136.82 82.37 1.93 Allowed 'General case' 0 N--CA 1.418 -2.033 0 CA-C-O 122.105 0.955 . . . . 74.450000000000003 109.379 -178.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 36.8 t-80 -119.63 165.92 13.84 Favored 'General case' 0 C--N 1.275 -2.656 0 N-CA-C 106.347 -1.723 . . . . 70.409999999999997 106.347 173.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.469 ' OE1' ' HA ' ' A' ' 81' ' ' ALA . 20.2 tp10 -43.95 -34.93 1.83 Allowed 'General case' 0 CA--C 1.573 1.86 0 C-N-CA 125.636 1.574 . . . . 75.049999999999997 113.347 -175.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.487 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -99.91 -0.9 38.6 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.525 -0.735 . . . . 74.120000000000005 111.662 -173.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.2 m -69.52 138.21 53.13 Favored 'General case' 0 C--O 1.256 1.44 0 CA-C-O 121.409 0.623 . . . . 54.439999999999998 112.071 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.504 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.9 t-20 -82.32 112.99 19.8 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 115.441 -0.8 . . . . 70.439999999999998 110.235 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.528 ' HB3' HD12 ' A' ' 50' ' ' LEU . 80.4 mt -69.03 -34.16 74.78 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 114.536 1.31 . . . . 54.210000000000001 114.536 -175.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.5 mt -84.37 -19.8 9.0 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.662 0 CA-C-O 121.742 0.782 . . . . 74.019999999999996 109.664 -177.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -76.33 -34.17 59.0 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.675 -1.232 . . . . 70.530000000000001 107.675 173.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.23 -35.73 74.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.26 -0.882 . . . . 74.200000000000003 110.213 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.1 25.57 0.8 Allowed Glycine 0 N--CA 1.444 -0.789 0 C-N-CA 119.489 -1.339 . . . . 64.549999999999997 115.65 174.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 45' ' ' LEU . 30.6 mt -70.61 108.93 4.59 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 118.616 1.208 . . . . 74.329999999999998 111.344 175.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 3.7 p30 -68.86 167.89 14.67 Favored 'General case' 0 C--O 1.246 0.913 0 N-CA-C 108.749 -0.834 . . . . 73.310000000000002 108.749 174.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 18.7 m -75.98 -14.64 60.23 Favored 'General case' 0 N--CA 1.423 -1.787 0 N-CA-C 114.754 1.39 . . . . 63.509999999999998 114.754 -174.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.549 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 47.8 mm -75.16 -45.8 40.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.467 0 N-CA-C 106.495 -1.668 . . . . 63.130000000000003 106.495 176.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -54.57 -44.39 72.93 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 123.675 0.61 . . . . 71.310000000000002 110.055 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.509 ' HB3' HD11 ' A' ' 71' ' ' LEU . 42.1 mt -53.2 -51.45 62.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.363 -0.835 . . . . 75.25 111.292 175.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 20.0 ptp -81.36 -18.6 45.04 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.301 0.852 . . . . 75.209999999999994 113.301 -177.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.549 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 30.7 mtm180 -64.55 -40.12 94.99 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 107.855 -1.165 . . . . 73.040000000000006 107.855 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -65.82 -34.17 77.53 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.545 -1.207 . . . . 72.230000000000004 111.713 176.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 48.4 tp -58.0 -38.83 76.85 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.147 0.499 . . . . 71.450000000000003 110.881 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.84 -41.63 64.61 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.401 -0.818 . . . . 71.040000000000006 108.896 178.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.586 ' CH2' ' HB2' ' A' ' 24' ' ' LEU . 62.2 t90 -55.41 -42.96 74.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.419 1.088 . . . . 62.329999999999998 111.086 -178.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.451 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 26.2 m-85 -58.75 -40.71 84.65 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-O 122.446 1.117 . . . . 65.150000000000006 110.669 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.273 76.1 mtt180 -70.52 -12.19 61.41 Favored 'General case' 0 C--N 1.276 -2.61 0 CA-C-N 114.273 -1.33 . . . . 73.230000000000004 114.139 -170.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 9.6 mtmp? -46.31 -50.09 16.71 Favored 'General case' 0 N--CA 1.504 2.243 0 CA-C-O 121.723 0.773 . . . . 72.319999999999993 110.829 174.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.422 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 2.5 m-20 -99.01 9.0 44.46 Favored 'General case' 0 CA--C 1.497 -1.07 0 CA-C-N 114.702 -1.136 . . . . 62.310000000000002 109.842 -172.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 81.23 28.37 45.06 Favored Glycine 0 N--CA 1.426 -2.028 0 C-N-CA 120.638 -0.791 . . . . 70.120000000000005 112.305 -177.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' HB2' ' HB3' ' A' ' 62' ' ' PHE . 44.3 m-85 -72.53 155.8 39.69 Favored 'General case' 0 CA--C 1.481 -1.695 0 C-N-CA 119.325 -0.95 . . . . 71.109999999999999 109.706 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -129.46 82.7 2.09 Favored 'General case' 0 C--N 1.27 -2.862 0 CA-C-N 115.165 -0.925 . . . . 74.200000000000003 111.873 -165.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 70.4 mt -127.91 153.27 46.87 Favored 'General case' 0 C--O 1.253 1.276 0 CA-C-N 115.703 -0.681 . . . . 73.519999999999996 111.223 -178.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.5 p -113.75 142.41 46.08 Favored 'General case' 0 N--CA 1.42 -1.973 0 N-CA-C 106.266 -1.753 . . . . 72.120000000000005 106.266 169.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.583 HD12 HD12 ' A' ' 74' ' ' LEU . 16.6 tp -66.96 -24.14 66.03 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.302 0.572 . . . . 54.219999999999999 110.203 -176.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.7 ttp180 -44.94 -35.13 2.7 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 125.817 1.647 . . . . 60.0 110.984 174.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.469 ' CD ' HH22 ' A' ' 90' ' ' ARG . 30.2 mt-10 -86.03 -28.04 24.41 Favored 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 114.926 -1.034 . . . . 75.239999999999995 110.43 -173.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.583 HD12 HD12 ' A' ' 71' ' ' LEU . 31.4 mt -81.43 -20.0 41.3 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.712 -1.131 . . . . 72.340000000000003 110.083 -174.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -79.99 -37.61 33.89 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.61 -0.723 . . . . 74.400000000000006 109.415 171.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -64.74 -46.63 81.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.455 -0.793 . . . . 73.5 110.988 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -128.37 85.8 59.48 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 109.601 -0.518 . . . . 74.230000000000004 109.601 176.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.504 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 2.9 Cg_endo -82.6 86.24 1.52 Allowed 'Trans proline' 0 N--CA 1.426 -2.454 0 C-N-CA 121.155 1.237 . . . . 75.430000000000007 111.47 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.7 p -153.9 140.95 19.36 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.651 -1.611 . . . . 74.310000000000002 106.651 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.607 ' HB3' ' NH2' ' A' ' 25' ' ' ARG . 77.9 mt -50.22 -48.84 54.24 Favored 'General case' 0 C--N 1.309 -1.159 0 O-C-N 123.981 0.801 . . . . 74.430000000000007 111.706 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.469 ' HA ' ' OE1' ' A' ' 41' ' ' GLU . . . -46.3 -46.54 18.1 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 124.962 1.414 . . . . 64.109999999999999 112.887 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.519 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.17 -48.44 62.2 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-O 119.09 -0.481 . . . . 64.310000000000002 111.19 -177.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.524 ' CG ' HD22 ' A' ' 74' ' ' LEU . 3.9 m0 -60.53 -38.79 85.58 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 108.245 -1.02 . . . . 75.310000000000002 108.245 -178.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -61.34 -59.24 5.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.11 -1.405 . . . . 72.219999999999999 109.903 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.467 ' NE2' ' HB2' ' A' ' 88' ' ' LEU . 25.5 tp60 -63.84 -26.44 68.62 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 123.707 0.803 . . . . 73.409999999999997 111.845 -178.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 83.3 mt -67.23 -25.67 66.21 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 111.91 0.337 . . . . 63.210000000000001 111.91 176.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.603 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 50.3 mtt -71.14 -22.69 62.03 Favored 'General case' 0 C--O 1.2 -1.533 0 C-N-CA 120.392 -0.523 . . . . 73.340000000000003 110.005 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.467 ' HB2' ' NE2' ' A' ' 85' ' ' GLN . 1.2 mm? -93.51 -12.0 30.66 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 121.071 0.463 . . . . 64.209999999999994 110.735 179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.8 t -67.57 -31.08 70.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 107.253 -1.388 . . . . 72.030000000000001 107.253 171.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.488 ' HD3' ' N ' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -167.78 101.06 0.48 Allowed 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 114.782 -1.099 . . . . 72.329999999999998 110.142 174.219 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 55.4 m -81.39 -164.22 0.05 OUTLIER Pre-proline 0 C--N 1.308 -1.204 0 N-CA-C 105.917 -1.883 . . . . 61.210000000000001 105.917 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -73.12 114.38 4.02 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 CA-C-N 123.263 2.201 . . . . 52.399999999999999 106.578 168.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 C--O 1.267 2.006 0 N-CA-C 105.612 -1.996 . . . . 63.420000000000002 105.612 -171.261 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.625 ' OD2' ' HG3' ' A' ' 16' ' ' ARG . 15.4 t0 . . . . . 0 CA--C 1.5 -0.958 0 N-CA-C 108.045 -1.094 . . . . 73.409999999999997 108.045 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -170.97 22.57 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.978 0 O-C-N 124.393 1.058 . . . . 73.510000000000005 109.818 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.625 ' HG3' ' OD2' ' A' ' 14' ' ' ASP 0.306 0.0 OUTLIER -51.13 -45.53 61.64 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 115.354 1.613 . . . . 72.430000000000007 115.354 -176.366 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.509 ' H ' ' HD2' ' A' ' 16' ' ' ARG . 88.1 m-70 -78.72 -39.69 35.71 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.956 0.884 . . . . 75.0 111.093 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.76 -16.23 62.71 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.761 -1.109 . . . . 71.040000000000006 113.694 -174.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.07 -26.41 60.34 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.516 -0.311 . . . . 73.099999999999994 110.645 173.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.473 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 17.7 t70 -81.14 -42.83 20.29 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 107.2 -1.407 . . . . 73.209999999999994 107.2 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.623 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 60.7 t80 -54.48 -35.99 63.67 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.108 0.963 . . . . 72.209999999999994 112.162 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.655 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 52.3 tp60 -45.17 -52.29 9.51 Favored 'General case' 0 C--O 1.209 -1.074 0 O-C-N 124.376 1.048 . . . . 65.030000000000001 109.662 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.57 -33.23 71.17 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.44 0.696 . . . . 73.510000000000005 111.927 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' CE3' ' A' ' 58' ' ' TRP . 4.6 tt -66.25 -34.91 79.08 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.136 -0.69 . . . . 64.0 109.136 177.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.62 HH12 ' NE2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -83.91 -34.93 24.42 Favored 'General case' 0 N--CA 1.418 -2.052 0 CA-C-N 115.521 -0.763 . . . . 73.010000000000005 110.903 -172.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 1.4 mm-40 -63.51 -37.53 87.65 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 108.286 -1.005 . . . . 72.409999999999997 108.286 178.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 29.0 ttt85 -73.36 -37.4 66.06 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 120.024 -0.67 . . . . 73.209999999999994 110.589 173.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.551 HD13 ' CD1' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -56.42 -30.21 62.53 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 112.24 0.459 . . . . 73.519999999999996 112.24 -177.246 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.71 -50.41 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 CA-C-O 121.317 0.579 . . . . 74.239999999999995 109.711 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -70.9 -33.22 70.34 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.696 -0.684 . . . . 65.530000000000001 111.259 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.405 ' CD ' ' HD2' ' A' ' 54' ' ' ARG . 9.1 tp10 -47.33 -53.26 14.12 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 125.556 1.542 . . . . 63.130000000000003 112.464 -175.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' HB2' ' CD1' ' A' ' 34' ' ' LEU . 82.8 mt -107.92 10.16 28.54 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.036 -0.666 . . . . 73.030000000000001 110.911 176.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 60.56 42.22 14.43 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 121.892 0.853 . . . . 75.140000000000001 110.404 -176.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' CD1' ' HB2' ' A' ' 32' ' ' LEU . 1.5 mp -79.65 130.93 35.8 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 108.055 -1.091 . . . . 71.239999999999995 108.055 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.512 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 74.9 p -79.65 157.61 74.34 Favored Pre-proline 0 C--N 1.296 -1.733 0 N-CA-C 107.933 -1.136 . . . . 53.340000000000003 107.933 176.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -63.55 -1.7 3.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 122.457 2.105 . . . . 73.219999999999999 112.793 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -84.19 -26.19 28.95 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.539 -0.911 . . . . 41.229999999999997 108.539 177.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 35' ' ' THR . 15.5 pt20 -115.07 -14.09 11.82 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.561 -0.745 . . . . 54.130000000000003 110.432 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -108.15 94.25 4.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.931 0.872 . . . . 65.310000000000002 110.461 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.473 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 25.2 t-80 -130.73 164.53 24.89 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 102.658 -3.089 . . . . 71.439999999999998 102.658 167.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.454 ' HA ' ' HB3' ' A' ' 80' ' ' LEU 0.5 9.1 pt-20 -77.87 -2.36 36.28 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 118.63 2.826 . . . . 75.239999999999995 118.63 -169.519 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -91.63 -7.3 50.41 Favored 'General case' 0 C--N 1.314 -0.949 0 O-C-N 121.26 -0.9 . . . . 74.319999999999993 108.711 177.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.7 t -66.52 140.09 57.97 Favored 'General case' 0 C--O 1.263 1.77 0 CA-C-N 114.858 -1.064 . . . . 74.140000000000001 111.186 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -86.6 111.92 21.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.224 -0.898 . . . . 74.030000000000001 108.939 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.4 mt -74.3 -21.36 59.76 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 113.446 0.906 . . . . 61.140000000000001 113.446 -174.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.6 mm -71.83 -36.8 59.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.429 -0.952 . . . . 54.109999999999999 108.429 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -79.19 -17.43 54.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.082 -0.963 . . . . 75.25 109.808 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.44 -16.83 44.29 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.411 -0.813 . . . . 52.100000000000001 109.824 177.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.64 26.55 7.56 Favored Glycine 0 N--CA 1.435 -1.423 0 CA-C-N 115.55 -0.75 . . . . 74.230000000000004 114.654 175.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 tp -74.62 116.81 15.74 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 106.109 -1.811 . . . . 73.310000000000002 106.109 174.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -78.04 164.62 24.88 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 119.561 -0.856 . . . . 72.409999999999997 109.7 -174.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 7.6 m -70.65 -19.86 62.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 112.708 0.633 . . . . 75.519999999999996 112.708 -176.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.601 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 48.9 mm -76.67 -42.05 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.353 0 N-CA-C 106.946 -1.501 . . . . 74.140000000000001 106.946 176.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HD2' ' CD ' ' A' ' 31' ' ' GLU . 1.6 tpp180 -54.82 -48.06 73.28 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.931 -1.137 . . . . 65.420000000000002 107.931 176.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.54 -47.35 79.62 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 113.341 -1.754 . . . . 74.510000000000005 110.397 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 19.8 ptp -81.66 -18.69 43.68 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.152 -0.619 . . . . 70.329999999999998 111.935 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.601 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 6.1 mmp_? -63.85 -40.5 96.72 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.662 -1.236 . . . . 74.150000000000006 107.662 176.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.586 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 10.8 m95 -60.93 -35.43 76.7 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.072 -1.422 . . . . 70.420000000000002 113.095 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.3 tp -55.82 -39.13 70.92 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.497 0.665 . . . . 72.409999999999997 109.942 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 m80 -70.77 -30.67 67.22 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.857 -1.065 . . . . 55.43 109.702 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.518 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 41.0 t90 -71.09 -33.91 70.63 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.739 -0.664 . . . . 72.329999999999998 109.927 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.569 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 79.1 m-85 -68.29 -59.19 3.38 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.62 -0.881 . . . . 73.209999999999994 108.62 173.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -53.83 -24.47 15.7 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 114.373 -1.285 . . . . 73.230000000000004 112.214 -176.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 61' ' ' TRP . 2.1 ttpm? -41.82 -50.45 4.37 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 127.041 2.136 . . . . 64.5 112.77 173.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -114.82 29.11 8.26 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 122.747 1.26 . . . . 74.230000000000004 109.281 -171.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 89.72 -11.08 71.41 Favored Glycine 0 C--O 1.248 0.978 0 CA-C-N 114.876 -1.056 . . . . 64.519999999999996 113.154 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.569 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 34.6 m-85 -61.09 159.55 11.6 Favored 'General case' 0 CA--C 1.486 -1.493 0 C-N-CA 123.088 0.555 . . . . 73.319999999999993 111.206 -178.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.587 ' NH1' ' HB2' ' A' ' 93' ' ' GLU . 16.7 ptp180 -153.19 135.31 14.82 Favored 'General case' 0 C--N 1.278 -2.514 0 C-N-CA 118.996 -1.082 . . . . 63.299999999999997 112.545 -166.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -168.48 176.45 5.76 Favored 'General case' 0 C--N 1.298 -1.643 0 N-CA-C 107.039 -1.467 . . . . 74.049999999999997 107.039 168.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.5 p -113.2 142.1 46.18 Favored 'General case' 0 N--CA 1.415 -2.221 0 N-CA-C 108.128 -1.064 . . . . 72.140000000000001 108.128 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.526 HD12 HD12 ' A' ' 74' ' ' LEU . 17.9 tp -66.32 -24.33 66.52 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.115 0.483 . . . . 74.450000000000003 111.489 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.4 ppt_? -60.7 -15.76 32.42 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.779 -0.646 . . . . 75.049999999999997 110.758 178.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -86.09 -26.46 25.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.772 -0.649 . . . . 74.319999999999993 110.136 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.526 HD12 HD12 ' A' ' 71' ' ' LEU . 16.1 mt -82.12 -22.99 35.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.469 -0.787 . . . . 64.120000000000005 110.19 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -84.24 -32.17 24.6 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.665 -0.698 . . . . 71.430000000000007 109.718 173.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.35 -47.37 73.64 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.048 -0.524 . . . . 52.219999999999999 110.294 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.34 86.47 57.01 Favored Pre-proline 0 N--CA 1.432 -1.357 0 N-CA-C 108.282 -1.007 . . . . 53.549999999999997 108.282 175.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -80.77 86.47 1.64 Allowed 'Trans proline' 0 N--CA 1.427 -2.422 0 C-N-CA 121.039 1.159 . . . . 72.25 111.942 -176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.3 p -153.25 140.83 19.86 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.21 -1.404 . . . . 72.010000000000005 107.21 177.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.551 ' CD1' HD13 ' A' ' 28' ' ' LEU . 31.1 tp -52.43 -49.8 63.83 Favored 'General case' 0 C--N 1.289 -2.04 0 O-C-N 124.237 0.961 . . . . 50.310000000000002 111.322 -177.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.446 ' N ' ' HB2' ' A' ' 41' ' ' GLU . . . -54.95 -35.05 63.83 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.062 0.945 . . . . 75.319999999999993 112.407 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.568 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -60.59 -46.0 91.89 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 121.281 -0.168 . . . . 71.099999999999994 110.757 -178.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.504 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -65.94 -38.27 88.2 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 107.936 -1.135 . . . . 70.319999999999993 107.936 -176.865 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -62.28 -51.7 66.67 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 113.921 -1.49 . . . . 73.120000000000005 110.06 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.92 -28.66 64.67 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.684 -0.689 . . . . 72.239999999999995 111.352 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 73.3 mt -59.51 -34.6 72.82 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 112.132 0.419 . . . . 64.310000000000002 112.132 177.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.623 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 40.5 mtt -55.17 -55.7 28.23 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.167 0.508 . . . . 72.510000000000005 110.433 174.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.37 -38.81 88.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.312 -0.858 . . . . 63.149999999999999 112.163 177.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 28.4 m -68.22 -35.82 78.55 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 116.198 -0.456 . . . . 62.509999999999998 111.882 -177.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 16.4 mmm-85 -78.29 -48.43 15.71 Favored 'General case' 0 CA--C 1.507 -0.711 0 C-N-CA 120.555 -0.458 . . . . 74.420000000000002 111.1 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.443 ' HB3' ' CD ' ' A' ' 92' ' ' PRO . 66.7 m 59.79 -172.91 0.02 OUTLIER Pre-proline 0 CA--C 1.583 2.245 0 O-C-N 123.88 0.738 . . . . 61.420000000000002 110.41 -176.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.443 ' CD ' ' HB3' ' A' ' 91' ' ' SER . 3.0 Cg_exo -80.52 118.51 3.56 Favored 'Trans proline' 0 C--N 1.363 1.313 0 CA-C-N 120.848 1.339 . . . . 75.120000000000005 111.01 172.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.587 ' HB2' ' NH1' ' A' ' 68' ' ' ARG . 7.2 mt-10 . . . . . 0 C--O 1.283 2.837 0 N-CA-C 105.751 -1.944 . . . . 71.129999999999995 105.751 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 CA--C 1.518 -0.285 0 N-CA-C 106.131 -1.803 . . . . 73.329999999999998 106.131 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -140.66 24.61 2.22 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.488 -0.768 . . . . 54.229999999999997 112.269 -177.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.486 ' HD3' HD12 ' A' ' 88' ' ' LEU 0.284 0.0 OUTLIER -57.01 -49.38 75.96 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.957 1.095 . . . . 74.019999999999996 113.957 -174.435 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.08 -36.52 48.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.582 0.706 . . . . 74.129999999999995 110.3 177.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.657 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -61.45 -15.98 42.53 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 114.376 1.25 . . . . 75.420000000000002 114.376 -174.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.84 -29.51 62.92 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-O 120.835 0.35 . . . . 53.240000000000002 110.961 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.526 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 27.6 t70 -70.86 -36.93 73.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 108.731 -0.84 . . . . 73.409999999999997 108.731 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.564 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 48.3 t80 -62.9 -22.71 66.93 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 115.314 -0.857 . . . . 65.450000000000003 111.366 -178.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -59.17 -33.94 71.52 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.124 0.487 . . . . 73.319999999999993 109.845 178.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.5 mt-30 -69.66 -38.39 77.08 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.652 -0.87 . . . . 54.299999999999997 108.652 177.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.517 HD22 ' CE2' ' A' ' 21' ' ' TYR . 5.0 tt -67.59 -26.52 66.31 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.935 -0.575 . . . . 74.109999999999999 110.343 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.557 ' HD3' HD11 ' A' ' 80' ' ' LEU . 22.3 mmm-85 -59.36 -56.6 19.98 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.58 -0.526 . . . . 73.530000000000001 109.58 171.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.54 ' OE1' ' HD2' ' A' ' 27' ' ' ARG . 5.1 tm-20 -50.7 -47.85 58.92 Favored 'General case' 0 CA--C 1.515 -0.367 0 O-C-N 124.705 1.253 . . . . 35.130000000000003 108.615 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.54 ' HD2' ' OE1' ' A' ' 26' ' ' GLU . 15.3 mmm180 -61.27 -48.6 80.67 Favored 'General case' 0 C--O 1.19 -2.049 0 CA-C-N 115.143 -0.935 . . . . 72.510000000000005 112.574 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.5 mt -58.58 -47.01 85.73 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.468 0.576 . . . . 74.019999999999996 111.145 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.496 HG23 ' O ' ' A' ' 34' ' ' LEU . 89.3 mt -60.57 -36.24 68.86 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.488 -1.233 . . . . 74.120000000000005 110.285 -177.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -84.4 -53.66 5.3 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-O 121.069 0.461 . . . . 72.439999999999998 111.08 177.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -63.42 -35.29 79.92 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 116.036 1.865 . . . . 65.129999999999995 116.036 -173.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.49 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 5.7 mp -96.88 -6.72 35.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 118.515 -1.274 . . . . 65.25 111.021 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.6 t30 61.32 74.16 0.45 Allowed 'General case' 0 C--O 1.246 0.884 0 CA-C-O 122.522 1.153 . . . . 74.409999999999997 108.866 -172.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.496 ' O ' HG23 ' A' ' 29' ' ' ILE . 46.2 mt -120.46 130.57 54.36 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.33 -1.359 . . . . 73.310000000000002 107.33 -176.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.404 ' OG1' ' HB2' ' A' ' 38' ' ' GLN . 32.4 p -79.33 163.55 58.84 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 108.697 -0.853 . . . . 74.129999999999995 108.697 176.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -63.27 -20.3 70.28 Favored 'Trans proline' 0 N--CA 1.485 0.984 0 C-N-CA 121.918 1.746 . . . . 71.450000000000003 112.213 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -84.47 -25.19 29.07 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.425 0.631 . . . . 73.540000000000006 109.493 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' HB2' ' OG1' ' A' ' 35' ' ' THR . 45.6 tt0 -85.47 -43.18 13.8 Favored 'General case' 0 N--CA 1.434 -1.258 0 N-CA-C 108.479 -0.934 . . . . 75.019999999999996 108.479 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.36 75.48 1.62 Allowed 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 108.718 -0.845 . . . . 71.430000000000007 108.718 177.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -94.38 165.23 12.67 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 107.0 -1.482 . . . . 75.439999999999998 107.0 171.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' CD ' HH12 ' A' ' 25' ' ' ARG . 6.3 mm-40 -53.18 -34.47 57.06 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 114.61 1.337 . . . . 72.219999999999999 114.61 -171.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.72 4.44 43.1 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.786 -0.571 . . . . 64.019999999999996 110.848 -174.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 26.2 t -66.29 136.5 55.92 Favored 'General case' 0 C--O 1.26 1.612 0 CA-C-O 121.397 0.617 . . . . 74.540000000000006 110.859 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 43.4 t-20 -83.13 101.11 10.96 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.376 -0.829 . . . . 63.229999999999997 109.14 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.504 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 31.5 mt -58.53 -28.5 65.52 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 114.786 1.402 . . . . 74.239999999999995 114.786 -176.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.2 mm -68.65 -34.82 67.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 109.175 -0.676 . . . . 60.109999999999999 109.175 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -82.87 -10.82 58.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.176 -0.92 . . . . 73.209999999999994 109.85 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.96 -4.2 58.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.232 -0.895 . . . . 44.299999999999997 108.763 175.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.09 44.37 2.83 Favored Glycine 0 N--CA 1.43 -1.749 0 CA-C-N 114.874 -1.057 . . . . 72.409999999999997 112.81 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -100.95 97.08 7.7 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.959 -0.756 . . . . 72.420000000000002 108.959 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -68.87 170.73 9.1 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.666 -1.152 . . . . 63.520000000000003 109.567 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 21.6 m -78.32 -14.59 59.35 Favored 'General case' 0 N--CA 1.426 -1.644 0 N-CA-C 115.224 1.565 . . . . 63.329999999999998 115.224 -175.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 49.9 mm -80.64 -42.76 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.639 0 N-CA-C 106.473 -1.677 . . . . 73.409999999999997 106.473 174.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.527 ' O ' ' HB2' ' A' ' 57' ' ' ARG . 25.5 ttm180 -63.82 -24.59 67.81 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 115.477 -0.783 . . . . 73.319999999999993 109.531 175.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.5 tp -78.42 -37.72 43.13 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.976 -0.556 . . . . 75.5 109.541 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.4 tpp -73.99 -29.03 61.75 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.063 -1.088 . . . . 74.329999999999998 108.063 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.527 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 7.0 mmm180 -53.45 -33.07 52.76 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 113.432 -1.713 . . . . 63.299999999999997 110.523 174.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.503 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 23.1 m95 -83.6 -32.71 25.59 Favored 'General case' 0 N--CA 1.42 -1.966 0 N-CA-C 113.441 0.904 . . . . 74.129999999999995 113.441 -178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.4 tp -59.2 -43.63 92.23 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 120.777 0.322 . . . . 71.109999999999999 111.035 -178.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -76.37 -18.23 58.98 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 120.372 -0.531 . . . . 75.200000000000003 110.544 179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.721 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 53.6 t90 -77.63 -37.32 50.37 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 109.22 -0.659 . . . . 71.299999999999997 109.22 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.657 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 88.2 m-85 -64.71 -53.86 40.65 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.886 -1.153 . . . . 75.129999999999995 107.886 172.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -12.84 3.66 Favored 'General case' 0 C--N 1.288 -2.068 0 N-CA-C 115.808 1.781 . . . . 74.049999999999997 115.808 -175.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.721 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 32.2 mtmm -42.06 -51.45 4.53 Favored 'General case' 0 N--CA 1.528 3.438 0 C-N-CA 123.943 0.897 . . . . 71.049999999999997 112.099 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -114.12 19.69 16.22 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.014 -0.994 . . . . 55.43 109.675 -174.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 82.92 37.35 13.18 Favored Glycine 0 N--CA 1.418 -2.545 0 CA-C-N 115.113 -0.949 . . . . 53.299999999999997 113.122 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.657 ' HB2' ' O ' ' A' ' 62' ' ' PHE . 19.8 m-85 -75.31 164.61 26.25 Favored 'General case' 0 CA--C 1.476 -1.866 0 C-N-CA 119.704 -0.799 . . . . 74.510000000000005 109.308 172.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.2 mmt180 -132.58 107.27 8.33 Favored 'General case' 0 C--N 1.282 -2.336 0 C-N-CA 118.382 -1.327 . . . . 74.439999999999998 113.034 -162.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 62' ' ' PHE . 3.1 pp -167.88 153.56 7.21 Favored 'General case' 0 CA--C 1.498 -1.058 0 O-C-N 124.424 1.077 . . . . 74.209999999999994 111.804 165.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 p -96.2 142.9 27.81 Favored 'General case' 0 N--CA 1.408 -2.565 0 N-CA-C 107.684 -1.228 . . . . 61.119999999999997 107.684 173.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.539 HD12 HD12 ' A' ' 74' ' ' LEU . 17.9 tp -71.5 -23.85 61.87 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.796 0.665 . . . . 65.310000000000002 112.796 -171.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.484 ' HB2' ' OE1' ' A' ' 73' ' ' GLU . 21.9 mtm180 -54.41 -30.34 52.07 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.816 0.817 . . . . 62.200000000000003 108.813 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.484 ' OE1' ' HB2' ' A' ' 72' ' ' ARG . 2.9 mm-40 -76.03 -24.76 55.22 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.046 -1.434 . . . . 73.129999999999995 109.963 -169.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.539 HD12 HD12 ' A' ' 71' ' ' LEU . 25.8 mt -81.47 -17.53 48.38 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.115 -0.948 . . . . 51.340000000000003 109.378 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -82.54 -40.37 21.06 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.829 -0.804 . . . . 74.239999999999995 108.829 172.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.86 -48.57 78.45 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.224 -0.898 . . . . 44.140000000000001 110.786 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.82 84.73 60.37 Favored Pre-proline 0 N--CA 1.435 -1.194 0 N-CA-C 109.414 -0.587 . . . . 73.109999999999999 109.414 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.475 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 18.3 Cg_endo -87.18 86.43 0.75 Allowed 'Trans proline' 0 N--CA 1.42 -2.84 0 C-N-CA 121.035 1.157 . . . . 71.409999999999997 111.925 -177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 p -152.34 144.02 23.54 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.13 -1.433 . . . . 73.239999999999995 107.13 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.557 HD11 ' HD3' ' A' ' 25' ' ' ARG . 2.4 tm? -51.73 -50.95 59.56 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 123.989 0.806 . . . . 63.100000000000001 110.538 -177.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.82 -40.09 59.88 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 124.074 0.859 . . . . 62.520000000000003 111.745 -179.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.599 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.0 -49.44 57.78 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.284 0.365 . . . . 24.32 111.32 -178.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 6.3 m0 -58.16 -42.31 85.69 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.696 -0.853 . . . . 73.239999999999995 108.696 -179.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -63.17 -50.18 71.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.449 -1.25 . . . . 74.450000000000003 111.217 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.468 ' HG2' ' HA ' ' A' ' 82' ' ' ALA . 16.1 pt20 -68.89 -27.77 66.09 Favored 'General case' 0 C--O 1.207 -1.177 0 CA-C-O 119.257 -0.401 . . . . 63.340000000000003 110.141 -178.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 77.0 mt -61.03 -34.98 75.7 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 112.712 0.634 . . . . 72.25 112.712 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.657 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 40.3 mtt -53.48 -37.49 62.75 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.403 0.621 . . . . 74.299999999999997 110.487 174.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.486 HD12 ' HD3' ' A' ' 16' ' ' ARG . 1.3 mm? -88.7 -41.93 12.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.585 -0.734 . . . . 74.519999999999996 112.684 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.8 m -69.79 -23.61 63.37 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 122.983 0.513 . . . . 73.549999999999997 112.153 -174.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 86' ' ' LEU . 16.6 mmm180 -81.04 -58.91 2.86 Favored 'General case' 0 CA--C 1.494 -1.2 0 C-N-CA 120.166 -0.613 . . . . 74.439999999999998 109.436 177.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.472 ' HB2' ' HD3' ' A' ' 92' ' ' PRO 0.301 48.9 m 67.99 -83.61 0.0 OUTLIER Pre-proline 0 CA--C 1.589 2.468 0 CA-C-O 117.621 -1.181 . . . . 64.200000000000003 111.48 -169.455 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 91' ' ' SER . 47.8 Cg_endo -98.14 117.99 0.13 Allowed 'Trans proline' 0 C--N 1.386 2.527 0 CA-C-N 123.639 2.335 . . . . 74.319999999999993 112.452 168.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 . . . . . 0 N--CA 1.481 1.108 0 C-N-CA 125.343 1.457 . . . . 70.319999999999993 114.485 177.578 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 110.131 -0.322 . . . . 74.010000000000005 110.131 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -155.17 104.54 2.45 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 118.06 0.391 . . . . 74.349999999999994 110.177 173.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.611 ' HD3' ' C ' ' A' ' 93' ' ' GLU . 1.8 mpt_? -111.0 -67.56 0.99 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.031 0.919 . . . . 72.540000000000006 109.511 173.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.41 ' HB3' ' CE2' ' A' ' 67' ' ' TYR . 70.2 m80 -75.6 -33.35 60.54 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.331 -1.304 . . . . 72.010000000000005 111.772 -173.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -67.34 -14.33 62.82 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 114.445 -1.252 . . . . 70.209999999999994 113.902 -175.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -53.54 -35.43 60.71 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 110.175 -0.306 . . . . 51.539999999999999 110.175 172.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -71.81 -39.22 69.97 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 107.987 -1.116 . . . . 74.209999999999994 107.987 176.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.552 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 86.0 t80 -56.79 -22.74 38.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.18 1.392 . . . . 74.430000000000007 112.252 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -58.35 -44.84 88.95 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 108.453 -0.943 . . . . 60.350000000000001 108.453 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.6 mm-40 -64.55 -29.29 70.32 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.48 -0.782 . . . . 71.219999999999999 111.554 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.52 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 8.3 tt -71.77 -32.26 67.48 Favored 'General case' 0 C--O 1.196 -1.721 0 C-N-CA 120.589 -0.444 . . . . 64.329999999999998 109.827 176.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' CD ' HD13 ' A' ' 80' ' ' LEU . 9.6 mmm180 -76.04 -49.1 18.46 Favored 'General case' 0 CA--C 1.483 -1.623 0 N-CA-C 108.231 -1.026 . . . . 74.239999999999995 108.231 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 27' ' ' ARG . 45.2 mt-10 -51.94 -46.73 64.84 Favored 'General case' 0 N--CA 1.435 -1.183 0 O-C-N 124.474 1.109 . . . . 71.439999999999998 110.753 176.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -75.8 -46.8 28.64 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 113.264 0.839 . . . . 73.340000000000003 113.264 179.335 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.52 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -67.34 -36.15 80.84 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.122 0.874 . . . . 72.510000000000005 112.082 -176.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.535 HG12 HD13 ' A' ' 39' ' ' LEU . 97.1 mt -72.52 -24.62 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 CA-C-O 121.732 0.777 . . . . 71.230000000000004 109.611 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -84.04 -36.0 23.41 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.607 -0.724 . . . . 65.349999999999994 109.352 175.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 8.0 tp10 -46.73 -54.29 10.0 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 127.649 2.38 . . . . 72.200000000000003 113.32 -176.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.538 HD11 HD23 ' A' ' 50' ' ' LEU . 94.1 mt -105.86 16.63 24.91 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.738 -0.785 . . . . 74.099999999999994 111.564 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 t30 56.65 58.36 4.18 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 123.008 1.385 . . . . 74.25 108.354 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.432 HD13 HD12 ' A' ' 39' ' ' LEU . 19.0 mt -102.8 168.5 9.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 113.771 -1.559 . . . . 35.32 109.042 -176.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.406 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 10.3 p -141.19 158.63 63.85 Favored Pre-proline 0 C--N 1.279 -2.478 0 N-CA-C 105.853 -1.906 . . . . 53.240000000000002 105.853 177.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -57.79 -19.95 41.15 Favored 'Trans proline' 0 CA--C 1.552 1.403 0 C-N-CA 122.46 2.107 . . . . 73.150000000000006 113.397 -178.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.406 ' OE1' ' HB ' ' A' ' 35' ' ' THR . 21.9 mp0 -74.26 -32.63 63.02 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 120.905 0.384 . . . . 54.450000000000003 111.136 178.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -98.65 -31.31 11.99 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.168 0.508 . . . . 73.340000000000003 110.713 178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.535 HD13 HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -107.17 88.7 2.79 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.56 -1.274 . . . . 72.150000000000006 107.56 177.214 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -94.96 165.09 12.62 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 103.975 -2.602 . . . . 74.409999999999997 103.975 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.513 ' HB3' ' HB2' ' A' ' 81' ' ' ALA . 35.5 mm-40 -52.98 -42.04 65.17 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.665 0.745 . . . . 63.219999999999999 110.506 -178.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -80.79 0.19 35.91 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 125.891 1.676 . . . . 62.409999999999997 113.512 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.3 m -74.82 128.41 35.49 Favored 'General case' 0 C--O 1.247 0.957 0 C-N-CA 120.058 -0.657 . . . . 54.450000000000003 110.289 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.537 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 23.8 t-20 -73.4 114.16 11.3 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 115.868 -0.606 . . . . 71.200000000000003 110.198 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.6 mt -66.51 -24.38 66.39 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 114.335 1.235 . . . . 42.329999999999998 114.335 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.0 mm -74.97 -38.0 42.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 109.033 -0.728 . . . . 71.0 109.033 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -72.78 -25.12 61.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.41 -0.813 . . . . 55.219999999999999 110.286 177.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -69.94 -33.16 71.76 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.147 -0.686 . . . . 34.439999999999998 109.147 174.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.38 33.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.135 0 C-N-CA 120.28 -0.962 . . . . 50.030000000000001 115.184 174.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.538 HD23 HD11 ' A' ' 32' ' ' LEU . 40.9 mt -81.99 106.97 14.33 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-N 117.982 0.891 . . . . 41.43 109.663 174.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -66.99 163.78 19.11 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.72 -0.844 . . . . 73.019999999999996 108.72 175.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.9 p -72.24 -19.54 61.69 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 114.571 1.323 . . . . 74.230000000000004 114.571 -173.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.547 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 50.5 mm -76.61 -44.02 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.446 0 N-CA-C 106.906 -1.516 . . . . 63.530000000000001 106.906 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HD3' ' CD ' ' A' ' 31' ' ' GLU . 10.2 ttm180 -59.37 -39.14 82.33 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.261 -0.881 . . . . 73.299999999999997 108.884 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.56 -45.67 86.07 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 114.855 -1.066 . . . . 70.129999999999995 109.94 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 21.3 ptp -75.63 -18.58 59.64 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 121.95 -0.469 . . . . 61.399999999999999 111.173 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 36.4 mtm180 -63.14 -42.59 99.5 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 107.411 -1.329 . . . . 73.230000000000004 107.411 173.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 51.7 m95 -62.81 -35.98 81.69 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 114.474 -1.239 . . . . 72.109999999999999 112.485 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.406 HD22 ' HB2' ' A' ' 71' ' ' LEU . 61.9 tp -55.08 -40.83 70.81 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.331 0.586 . . . . 72.230000000000004 110.533 177.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -73.74 -32.09 63.68 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.536 -0.757 . . . . 71.299999999999997 110.848 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.611 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 62.6 t90 -66.41 -46.05 77.87 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.705 -0.68 . . . . 70.230000000000004 109.593 176.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -61.54 -47.97 83.13 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 122.202 1.001 . . . . 73.140000000000001 110.249 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -66.63 -12.16 56.86 Favored 'General case' 0 C--N 1.283 -2.312 0 CA-C-N 114.476 -1.238 . . . . 71.219999999999999 113.62 -172.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.611 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 31.0 mtmm -49.67 -50.86 41.78 Favored 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 121.672 0.749 . . . . 61.520000000000003 109.859 177.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -102.96 21.73 15.16 Favored 'General case' 0 C--O 1.248 0.979 0 CA-C-N 114.855 -1.066 . . . . 71.349999999999994 108.158 -176.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 60.19 47.15 92.49 Favored Glycine 0 N--CA 1.426 -1.987 0 CA-C-N 114.069 -1.423 . . . . 52.240000000000002 112.04 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 17' ' ' HIS 0.426 35.3 m-85 -61.94 151.54 34.6 Favored 'General case' 0 CA--C 1.48 -1.744 0 N-CA-C 113.895 1.072 . . . . 72.329999999999998 113.895 178.918 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -88.67 66.06 7.97 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-N 113.731 -1.577 . . . . 75.129999999999995 112.927 -159.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -160.65 178.04 9.88 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-O 121.751 0.786 . . . . 72.340000000000003 112.82 179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.4 m -133.7 167.75 19.96 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.359 -2.46 . . . . 71.439999999999998 104.359 177.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.406 ' HB2' HD22 ' A' ' 59' ' ' LEU . 25.6 tp -64.3 -27.42 69.02 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 119.0 0.818 . . . . 74.329999999999998 111.236 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -55.11 -34.37 63.64 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 108.921 -0.77 . . . . 54.0 108.921 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -71.34 -33.07 69.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.067 -1.424 . . . . 73.439999999999998 110.013 -169.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 56.6 mt -78.49 -22.6 47.24 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 114.58 -1.191 . . . . 42.420000000000002 110.135 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -82.29 -39.69 22.57 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.463 -0.569 . . . . 75.439999999999998 109.463 174.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.94 -47.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.343 -0.844 . . . . 74.549999999999997 111.229 -178.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -133.01 81.58 57.16 Favored Pre-proline 0 N--CA 1.434 -1.256 0 C-N-CA 120.426 -0.51 . . . . 62.329999999999998 110.884 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.537 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 7.9 Cg_endo -87.62 87.0 0.65 Allowed 'Trans proline' 0 N--CA 1.427 -2.413 0 C-N-CA 121.53 1.487 . . . . 71.219999999999999 111.302 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.0 p -155.02 141.55 18.81 Favored 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 104.859 -2.275 . . . . 73.340000000000003 104.859 178.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.562 HD13 ' CD ' ' A' ' 25' ' ' ARG . 12.2 mt -61.37 -27.41 68.5 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 118.703 -1.199 . . . . 73.519999999999996 112.717 -178.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.513 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -54.55 -46.89 73.73 Favored 'General case' 0 CA--C 1.516 -0.346 0 O-C-N 123.801 0.688 . . . . 64.25 110.291 176.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.625 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -69.82 -46.33 65.88 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.569 -0.741 . . . . 45.439999999999998 110.683 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.41 ' HE1' ' HA ' ' A' ' 78' ' ' PRO . 10.9 m0 -53.89 -35.36 61.51 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.163 0.585 . . . . 75.030000000000001 111.807 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.501 ' HB2' ' CZ ' ' A' ' 21' ' ' TYR . 33.0 t30 -75.89 -48.73 20.21 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.271 0.558 . . . . 71.400000000000006 110.834 178.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -67.46 -23.0 65.46 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.89 -0.595 . . . . 73.329999999999998 112.273 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.625 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 77.4 mt -61.98 -24.48 67.05 Favored 'General case' 0 C--N 1.321 -0.647 0 O-C-N 122.104 -0.372 . . . . 63.049999999999997 111.392 176.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.8 mtt -84.5 -63.08 1.4 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.134 0.492 . . . . 73.430000000000007 110.788 174.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.728 ' HG ' ' OXT' ' A' ' 93' ' ' GLU . 7.6 mp -69.6 -16.08 63.32 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 115.93 1.826 . . . . 55.009999999999998 115.93 -175.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.6 m -108.88 9.29 26.71 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.133 -0.979 . . . . 72.209999999999994 111.338 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -126.91 4.4 6.58 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.656 0.741 . . . . 73.420000000000002 110.364 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.473 ' HB3' ' HD2' ' A' ' 92' ' ' PRO . 74.3 m -162.93 179.33 1.27 Allowed Pre-proline 0 C--N 1.304 -1.377 0 N-CA-C 104.983 -2.229 . . . . 72.239999999999995 104.983 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' A' ' 91' ' ' SER . 49.6 Cg_exo -42.65 148.94 0.39 Allowed 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.096 1.864 . . . . 73.25 112.585 172.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.728 ' OXT' ' HG ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.425 0 N-CA-C 113.845 1.054 . . . . 61.109999999999999 113.845 -171.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 CA--C 1.537 0.478 0 CA-C-O 119.704 -0.189 . . . . 75.219999999999999 111.243 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.76 119.24 6.91 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 121.299 0.571 . . . . 61.520000000000003 111.43 178.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.562 ' H ' HD11 ' A' ' 88' ' ' LEU . 2.9 mpt_? -111.85 -75.75 0.61 Allowed 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 108.119 -1.067 . . . . 61.119999999999997 108.119 171.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.484 ' HB3' ' CE2' ' A' ' 67' ' ' TYR . 8.2 m-70 -78.01 -21.53 50.65 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 121.815 0.817 . . . . 62.240000000000002 110.461 174.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.537 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -60.81 -14.84 24.23 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 113.809 -1.541 . . . . 75.409999999999997 112.715 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.26 -29.86 10.54 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-O 121.195 0.522 . . . . 75.030000000000001 110.263 172.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -68.3 -44.79 74.69 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.652 -0.704 . . . . 74.129999999999995 109.371 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.507 ' CE2' HD22 ' A' ' 24' ' ' LEU . 68.4 t80 -64.27 -23.85 67.45 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.363 0.665 . . . . 62.229999999999997 110.736 178.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -60.01 -32.48 70.91 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.403 -0.592 . . . . 55.210000000000001 109.403 176.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.446 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 29.6 mm-40 -72.47 -43.39 63.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.886 -0.597 . . . . 74.209999999999994 110.312 176.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.507 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.3 tt -59.44 -37.24 77.6 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.907 -0.405 . . . . 65.239999999999995 109.907 177.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HD2' HD13 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -58.54 -48.17 81.75 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 75.340000000000003 109.805 -179.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.48 -43.93 95.88 Favored 'General case' 0 N--CA 1.432 -1.326 0 CA-C-N 115.42 -0.809 . . . . 74.310000000000002 110.922 -179.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -62.78 -34.52 77.41 Favored 'General case' 0 C--O 1.213 -0.86 0 C-N-CA 119.567 -0.853 . . . . 64.25 111.474 177.391 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.524 ' O ' HD12 ' A' ' 34' ' ' LEU . 15.2 mt -63.41 -30.69 71.77 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 112.778 0.659 . . . . 73.0 112.778 176.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.473 ' CD1' HD12 ' A' ' 39' ' ' LEU . 17.3 mm -60.83 -40.09 84.02 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.788 0 N-CA-C 108.439 -0.949 . . . . 60.210000000000001 108.439 176.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -79.33 -44.6 21.27 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.056 -0.52 . . . . 73.140000000000001 110.378 -178.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -44.86 -54.48 6.37 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.289 1.835 . . . . 74.140000000000001 114.996 -170.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.482 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 90.3 mt -106.49 20.28 19.22 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.702 -0.799 . . . . 72.299999999999997 111.266 -178.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t30 59.13 53.0 5.72 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 123.204 1.478 . . . . 72.120000000000005 107.787 -175.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.524 HD12 ' O ' ' A' ' 28' ' ' LEU . 64.4 mt -95.46 -176.9 3.91 Favored 'General case' 0 N--CA 1.421 -1.909 0 CA-C-N 113.963 -1.471 . . . . 74.150000000000006 108.486 -178.02 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -152.97 148.91 20.83 Favored Pre-proline 0 C--N 1.276 -2.595 0 N-CA-C 103.469 -2.789 . . . . 74.340000000000003 103.469 -177.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -51.06 -35.13 49.88 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.867 1.711 . . . . 73.219999999999999 112.931 179.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -0.8 29.76 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.141 0.496 . . . . 75.420000000000002 111.388 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.437 ' NE2' ' HA ' ' A' ' 34' ' ' LEU . 10.2 tt0 -119.9 -15.31 8.84 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.541 -0.911 . . . . 64.230000000000004 108.541 178.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.506 HD13 HD11 ' A' ' 80' ' ' LEU . 2.5 tm? -129.02 81.31 2.02 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-O 122.414 1.102 . . . . 64.549999999999997 109.235 -173.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -96.75 166.77 11.49 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.166 -2.288 . . . . 74.5 107.884 178.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.434 ' CD ' HH21 ' A' ' 25' ' ' ARG . 10.9 mm-40 -62.78 -26.51 68.75 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.353 -1.351 . . . . 53.109999999999999 107.353 170.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.29 -10.55 59.84 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.799 2.039 . . . . 74.310000000000002 111.453 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.7 m -79.24 120.04 23.17 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.276 0.56 . . . . 72.219999999999999 111.784 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.565 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 44.1 t-20 -69.83 112.63 6.4 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.445 -0.946 . . . . 70.530000000000001 108.445 175.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.43 HD11 HD23 ' A' ' 80' ' ' LEU . 51.2 mt -68.4 -30.63 69.58 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 114.089 1.144 . . . . 70.299999999999997 114.089 -176.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.5 mm -71.21 -35.28 57.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 108.342 -0.984 . . . . 72.519999999999996 108.342 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -72.24 -26.3 61.96 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.719 -1.128 . . . . 70.439999999999998 109.581 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.95 -11.56 59.82 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.615 -0.72 . . . . 70.030000000000001 110.132 177.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.38 31.58 10.41 Favored Glycine 0 N--CA 1.429 -1.788 0 CA-C-N 115.668 -0.696 . . . . 41.340000000000003 113.135 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.9 tp -75.88 101.36 5.12 Favored 'General case' 0 N--CA 1.421 -1.883 0 N-CA-C 107.493 -1.299 . . . . 64.519999999999996 107.493 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 54' ' ' ARG . 3.3 p30 -61.15 162.69 7.04 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-O 121.566 0.698 . . . . 74.450000000000003 110.187 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.415 ' O ' ' HG2' ' A' ' 56' ' ' MET . 20.0 m -74.34 -14.81 60.93 Favored 'General case' 0 N--CA 1.414 -2.231 0 N-CA-C 114.071 1.137 . . . . 71.409999999999997 114.071 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.679 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 48.1 mm -76.98 -44.38 31.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.37 0 N-CA-C 106.521 -1.659 . . . . 73.230000000000004 106.521 175.061 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 51' ' ' ASP . 1.0 OUTLIER -50.12 -49.16 52.69 Favored 'General case' 0 CA--C 1.503 -0.84 0 N-CA-C 108.692 -0.855 . . . . 72.010000000000005 108.692 175.104 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 10.3 tp -58.8 -52.88 63.84 Favored 'General case' 0 CA--C 1.553 1.081 0 O-C-N 125.564 1.79 . . . . 54.030000000000001 111.151 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 52' ' ' SER . 21.6 ptp -77.07 -18.75 57.82 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.826 1.047 . . . . 74.540000000000006 113.826 -177.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.679 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 66.5 mtm180 -61.37 -43.26 99.17 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.528 -1.286 . . . . 75.430000000000007 107.528 174.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.417 ' O ' ' HD1' ' A' ' 62' ' ' PHE . 18.2 m95 -64.53 -32.02 73.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.948 -1.478 . . . . 75.25 111.023 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.465 ' HB2' HD13 ' A' ' 71' ' ' LEU . 3.4 tm? -57.22 -35.62 69.89 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.597 0.759 . . . . 54.409999999999997 109.308 178.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 -81.63 -41.71 21.06 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.233 -0.439 . . . . 74.030000000000001 109.824 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.595 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 81.6 t90 -51.96 -42.88 63.23 Favored 'General case' 0 C--O 1.211 -0.973 0 C-N-CA 124.599 1.16 . . . . 72.120000000000005 112.587 -177.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 18.9 m-85 -63.96 -52.42 59.78 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-O 122.118 0.961 . . . . 71.230000000000004 112.642 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 -63.02 -13.44 35.51 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 116.442 2.016 . . . . 75.200000000000003 116.442 -166.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.595 ' HD2' ' O ' ' A' ' 61' ' ' TRP . 0.0 OUTLIER -62.14 -22.98 66.29 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.895 0.771 . . . . 65.319999999999993 111.693 -178.916 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -113.81 24.26 12.27 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 122.562 1.172 . . . . 63.119999999999997 108.322 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.39 42.52 89.62 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 114.635 -1.166 . . . . 64.409999999999997 112.563 179.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.484 ' CE2' ' HB3' ' A' ' 17' ' ' HIS . 21.8 m-85 -87.56 168.08 13.37 Favored 'General case' 0 CA--C 1.487 -1.475 0 C-N-CA 120.304 -0.558 . . . . 75.340000000000003 112.458 178.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.6 ttt180 -116.14 120.07 37.85 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.882 -1.054 . . . . 62.420000000000002 111.869 -170.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.406 HD12 HD11 ' A' ' 74' ' ' LEU . 1.4 pt? -168.76 138.91 2.36 Favored 'General case' 0 CA--C 1.483 -1.596 0 O-C-N 124.439 1.087 . . . . 71.099999999999994 111.035 161.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 72.0 p -103.94 142.63 34.09 Favored 'General case' 0 N--CA 1.396 -3.154 0 N-CA-C 103.464 -2.791 . . . . 72.329999999999998 103.464 165.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 59' ' ' LEU . 13.3 tp -68.04 -23.93 65.03 Favored 'General case' 0 C--N 1.292 -1.911 0 C-N-CA 119.738 -0.785 . . . . 74.0 111.933 -171.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.674 ' HD3' ' O ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.97 -21.85 66.67 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.774 -0.824 . . . . 73.230000000000004 108.774 -179.986 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.54 -34.94 65.44 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 121.541 0.686 . . . . 72.340000000000003 109.282 179.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.542 HD22 ' CD1' ' A' ' 83' ' ' TRP . 12.6 mt -73.25 -29.95 63.12 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.266 -0.879 . . . . 73.430000000000007 109.523 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -84.34 4.43 31.26 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.595 -0.73 . . . . 74.450000000000003 110.49 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.73 -53.14 3.38 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 108.613 -0.884 . . . . 61.539999999999999 108.613 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -125.42 88.36 54.29 Favored Pre-proline 0 N--CA 1.43 -1.455 0 N-CA-C 107.863 -1.162 . . . . 71.219999999999999 107.863 175.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.565 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 18.5 Cg_endo -82.59 86.81 1.45 Allowed 'Trans proline' 0 N--CA 1.427 -2.384 0 C-N-CA 121.018 1.145 . . . . 72.129999999999995 112.494 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' A' ' 41' ' ' GLU . 3.1 p -154.6 156.79 37.18 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 105.266 -2.124 . . . . 61.420000000000002 105.266 178.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.584 HD13 ' HD2' ' A' ' 25' ' ' ARG . 57.3 mt -57.08 -45.11 83.55 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.561 0.696 . . . . 64.120000000000005 110.955 -179.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.416 ' HB2' ' HB3' ' A' ' 41' ' ' GLU . . . -44.83 -44.93 9.86 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 113.433 -1.712 . . . . 65.349999999999994 113.129 -176.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.714 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -62.07 -48.6 79.49 Favored 'General case' 0 C--O 1.214 -0.804 0 O-C-N 123.073 0.233 . . . . 63.439999999999998 111.528 -178.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.542 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.1 OUTLIER -68.87 -34.08 74.84 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 107.916 -1.142 . . . . 73.0 107.916 -174.078 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -60.85 -50.2 74.41 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.624 -1.171 . . . . 74.5 109.125 177.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -70.43 -17.49 63.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.622 -0.717 . . . . 72.219999999999999 112.085 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 71.7 mt -68.41 -20.28 64.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.392 0.615 . . . . 72.25 110.692 176.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.537 ' SD ' ' HA ' ' A' ' 18' ' ' ALA . 57.3 mtt -81.93 -39.24 24.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 120.514 -0.474 . . . . 64.049999999999997 110.235 173.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.562 HD11 ' H ' ' A' ' 16' ' ' ARG . 2.9 mm? -73.46 -27.2 61.28 Favored 'General case' 0 C--O 1.194 -1.83 0 N-CA-C 112.677 0.621 . . . . 73.099999999999994 112.677 179.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.7 p -81.23 12.52 3.46 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.77 0.795 . . . . 71.540000000000006 111.155 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.41 -0.68 6.28 Favored 'General case' 0 N--CA 1.401 -2.915 0 C-N-CA 126.069 1.748 . . . . 72.209999999999994 108.593 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.9 m -140.69 -179.84 1.09 Allowed Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.147 -0.686 . . . . 65.310000000000002 109.147 -173.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -79.56 156.15 24.73 Favored 'Trans proline' 0 C--O 1.252 1.19 0 C-N-CA 121.398 1.399 . . . . 63.210000000000001 110.441 170.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 . . . . . 0 C--N 1.305 -1.337 0 N-CA-C 107.139 -1.43 . . . . 75.129999999999995 107.139 -179.999 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 . . . . . 0 CA--C 1.514 -0.424 0 N-CA-C 106.486 -1.672 . . . . 72.25 106.486 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -144.59 28.66 1.29 Allowed 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.378 0.423 . . . . 71.420000000000002 109.875 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.56 ' HD2' ' N ' ' A' ' 17' ' ' HIS 0.285 0.0 OUTLIER -55.56 -34.84 65.11 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 115.285 1.587 . . . . 71.310000000000002 115.285 -172.685 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.56 ' N ' ' HD2' ' A' ' 16' ' ' ARG . 67.3 m170 -78.51 -42.57 29.21 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 122.516 1.151 . . . . 62.439999999999998 109.726 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 21' ' ' TYR . . . -67.76 -15.37 63.6 Favored 'General case' 0 C--N 1.296 -1.754 0 CA-C-N 114.062 -1.426 . . . . 72.340000000000003 113.526 -173.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.31 -30.09 66.4 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.577 -0.283 . . . . 73.200000000000003 111.234 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -82.68 -27.03 31.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.525 0.678 . . . . 62.049999999999997 109.597 176.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.517 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 84.7 t80 -58.83 -26.75 64.45 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.752 -0.658 . . . . 54.039999999999999 109.648 174.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -58.84 -34.61 71.76 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.345 -0.843 . . . . 52.109999999999999 109.815 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -66.01 -36.87 84.45 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 121.484 0.659 . . . . 74.540000000000006 109.747 177.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.49 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.7 tt -67.33 -33.58 75.55 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-N 115.451 -0.795 . . . . 63.109999999999999 109.296 175.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 ttp180 -78.86 -44.3 23.19 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.443 -0.798 . . . . 65.120000000000005 112.014 -172.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.84 -44.26 81.93 Favored 'General case' 0 N--CA 1.427 -1.624 0 O-C-N 124.074 0.859 . . . . 62.119999999999997 109.944 174.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.516 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 33.5 mtp180 -64.19 -42.95 96.45 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 120.305 -0.558 . . . . 70.129999999999995 111.435 174.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 24' ' ' LEU . 1.3 tt -51.64 -38.16 53.53 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.165 0.986 . . . . 63.039999999999999 111.144 -177.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 55.1 mt -66.99 -36.55 77.41 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 115.986 -0.552 . . . . 74.230000000000004 111.785 178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -80.68 -33.27 35.58 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.67 -0.644 . . . . 74.019999999999996 111.299 176.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 27' ' ' ARG . 79.9 mm-40 -48.26 -53.51 16.9 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.036 0.934 . . . . 65.519999999999996 113.397 -177.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.554 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 81.6 mt -102.6 13.55 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.237 -0.985 . . . . 73.310000000000002 111.457 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 57.4 44.51 21.44 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 122.706 1.241 . . . . 74.219999999999999 109.339 -178.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.554 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 38.8 mt -79.75 131.07 35.83 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 114.379 -1.282 . . . . 75.329999999999998 110.86 -174.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -79.78 145.87 63.21 Favored Pre-proline 0 C--N 1.287 -2.129 0 N-CA-C 106.541 -1.651 . . . . 64.200000000000003 106.541 175.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.09 -29.08 81.85 Favored 'Trans proline' 0 N--CA 1.489 1.261 0 C-N-CA 122.037 1.825 . . . . 52.43 112.556 177.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.4 mp0 -77.91 -13.17 59.97 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.138 0.494 . . . . 75.209999999999994 110.682 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.451 ' OE1' ' HA ' ' A' ' 34' ' ' LEU . 65.6 tt0 -95.66 -46.59 6.55 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 108.251 -1.018 . . . . 65.040000000000006 108.251 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.409 HD23 ' HB3' ' A' ' 43' ' ' SER . 0.3 OUTLIER -97.05 76.47 2.68 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 108.845 -0.798 . . . . 63.420000000000002 108.845 178.979 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -76.22 165.37 24.98 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 106.908 -1.515 . . . . 72.409999999999997 106.908 169.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.75 -51.75 5.23 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.923 1.083 . . . . 74.400000000000006 113.923 -172.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -105.13 26.09 9.75 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 113.532 0.938 . . . . 64.400000000000006 113.532 -178.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.409 ' HB3' HD23 ' A' ' 39' ' ' LEU . 22.2 t -59.63 134.38 56.97 Favored 'General case' 0 C--O 1.245 0.862 0 N-CA-C 108.631 -0.877 . . . . 74.230000000000004 108.631 175.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.471 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 0.9 OUTLIER -73.01 99.14 2.66 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.998 -0.546 . . . . 75.129999999999995 110.835 -177.531 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.5 mt -55.45 -38.81 69.53 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.71 1.004 . . . . 74.340000000000003 113.71 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.428 HG12 ' CB ' ' A' ' 78' ' ' PRO . 45.9 mm -63.83 -35.14 72.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-O 121.055 0.455 . . . . 72.519999999999996 110.361 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -85.84 -10.86 54.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.215 0.531 . . . . 73.019999999999996 110.385 -178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -86.91 -12.39 47.84 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.829 -0.804 . . . . 64.230000000000004 108.829 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.48 22.96 7.47 Favored Glycine 0 N--CA 1.436 -1.348 0 CA-C-N 115.239 -0.891 . . . . 73.140000000000001 114.436 175.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.83 99.65 1.41 Allowed 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 107.704 -1.221 . . . . 74.0 107.704 176.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -64.47 153.24 39.45 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.557 -1.201 . . . . 71.519999999999996 108.833 178.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.419 ' O ' ' HG2' ' A' ' 56' ' ' MET . 37.5 m -72.26 -14.45 61.77 Favored 'General case' 0 N--CA 1.422 -1.861 0 N-CA-C 113.914 1.079 . . . . 62.219999999999999 113.914 -175.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.595 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 50.8 mm -75.29 -47.35 35.64 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 118.421 -1.312 . . . . 75.310000000000002 107.847 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.428 ' NE ' ' HB3' ' A' ' 31' ' ' GLU . 32.7 ttm105 -63.9 -35.93 82.27 Favored 'General case' 0 N--CA 1.438 -1.045 0 O-C-N 123.574 0.546 . . . . 75.129999999999995 109.619 178.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.448 ' HG ' HD11 ' A' ' 71' ' ' LEU . 14.8 tp -56.7 -49.86 73.88 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.03 -0.986 . . . . 52.340000000000003 109.064 176.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 52' ' ' SER . 19.5 ptp -80.73 -18.23 48.45 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.444 -0.502 . . . . 72.450000000000003 111.803 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 6.4 mmp_? -62.14 -40.13 94.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 107.921 -1.14 . . . . 74.340000000000003 107.921 176.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -63.43 -37.05 85.8 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.565 -1.198 . . . . 73.519999999999996 111.59 177.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 59.6 tp -59.81 -34.77 73.49 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.674 0.75 . . . . 74.519999999999996 109.781 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.631 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 45.7 m80 -72.14 -34.32 68.43 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.096 -0.956 . . . . 74.340000000000003 110.175 177.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 86.9 t90 -66.66 -58.55 4.89 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 124.594 1.183 . . . . 75.450000000000003 109.953 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.429 ' CZ ' HD21 ' A' ' 69' ' ' LEU . 53.8 m-85 -44.89 -55.23 5.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.746 0.818 . . . . 63.109999999999999 112.273 -177.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.315 86.1 mtt-85 -71.22 -12.67 61.59 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 115.203 1.557 . . . . 62.520000000000003 115.203 -173.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 44.1 mmtm -82.44 -35.38 27.6 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.871 -0.788 . . . . 74.230000000000004 108.871 173.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -80.77 -9.32 59.82 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.895 -1.048 . . . . 70.129999999999995 110.422 -179.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.73 -3.24 52.88 Favored Glycine 0 N--CA 1.443 -0.864 0 CA-C-N 115.841 -0.618 . . . . 45.119999999999997 112.567 177.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -83.01 160.86 21.89 Favored 'General case' 0 CA--C 1.483 -1.634 0 CA-C-O 121.048 0.451 . . . . 73.340000000000003 110.963 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.468 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 53.9 mtt180 -145.05 131.64 19.87 Favored 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.822 -0.751 . . . . 71.120000000000005 112.575 -167.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.429 HD21 ' CZ ' ' A' ' 62' ' ' PHE . 3.1 pp -168.8 172.78 7.59 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 125.421 1.488 . . . . 75.049999999999997 107.193 170.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.0 p -116.54 149.84 38.95 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 106.974 -1.491 . . . . 74.109999999999999 106.974 171.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.591 HD12 HD12 ' A' ' 74' ' ' LEU . 10.9 tp -66.42 -24.0 66.39 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 112.054 0.39 . . . . 75.450000000000003 112.054 -173.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 55.5 mtm180 -52.18 -32.46 36.21 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.885 0.85 . . . . 73.099999999999994 109.479 178.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -78.92 -27.69 43.78 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.092 -1.413 . . . . 75.0 110.182 -173.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.591 HD12 HD12 ' A' ' 71' ' ' LEU . 17.0 mt -82.47 -17.79 44.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.289 -0.869 . . . . 74.409999999999997 110.158 -178.418 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -82.72 -35.92 26.28 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.86 -0.609 . . . . 74.140000000000001 109.447 173.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.88 -42.2 85.98 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.532 -0.758 . . . . 64.150000000000006 110.626 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.38 90.75 23.93 Favored Pre-proline 0 N--CA 1.434 -1.253 0 N-CA-C 109.117 -0.697 . . . . 41.009999999999998 109.117 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.471 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 36.7 Cg_endo -93.63 85.82 0.16 Allowed 'Trans proline' 0 N--CA 1.422 -2.691 0 C-N-CA 121.035 1.157 . . . . 72.230000000000004 112.184 -179.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 38.9 p -147.49 174.03 12.1 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 104.859 -2.274 . . . . 73.230000000000004 104.859 178.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.5 mt -76.77 -44.07 34.39 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 120.431 1.469 . . . . 72.340000000000003 112.366 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 85' ' ' GLN . . . -60.73 -31.47 70.78 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.868 -0.605 . . . . 43.450000000000003 112.356 -173.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -59.41 -55.42 34.93 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 123.318 0.386 . . . . 64.409999999999997 110.99 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.453 ' CD1' HD22 ' A' ' 74' ' ' LEU . 1.0 OUTLIER -63.5 -39.18 93.77 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.681 -1.229 . . . . 73.019999999999996 107.681 -176.455 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -57.88 -50.37 73.54 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 113.6 -1.636 . . . . 71.109999999999999 110.694 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 81' ' ' ALA . 78.2 mt-30 -75.5 -32.12 60.42 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 116.156 -0.474 . . . . 74.409999999999997 111.295 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 92.6 mt -57.08 -32.25 66.07 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.348 0.499 . . . . 62.009999999999998 112.348 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.517 ' SD ' ' HB2' ' A' ' 21' ' ' TYR . 43.5 mtt -57.5 -52.08 66.86 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.468 0.651 . . . . 71.129999999999995 110.328 173.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -71.98 -36.28 69.74 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.873 0.694 . . . . 75.340000000000003 112.873 178.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 27.3 m -63.94 -22.29 66.86 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.611 0.569 . . . . 71.530000000000001 111.585 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.509 ' O ' ' HD2' ' A' ' 92' ' ' PRO . 54.4 mmt-85 -79.1 -74.89 0.26 Allowed 'General case' 0 N--CA 1.433 -1.324 0 C-N-CA 120.515 -0.474 . . . . 65.530000000000001 111.179 174.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . 0.303 45.6 m 62.03 -90.11 0.0 OUTLIER Pre-proline 0 CA--C 1.593 2.601 0 CA-C-O 117.461 -1.257 . . . . 64.519999999999996 111.002 -168.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 88.7 Cg_endo -87.28 153.85 8.05 Favored 'Trans proline' 0 C--N 1.388 2.642 0 CA-C-N 123.494 2.284 . . . . 60.119999999999997 111.507 170.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.468 ' OE1' ' HD3' ' A' ' 68' ' ' ARG . 21.2 tt0 . . . . . 0 N--CA 1.431 -1.378 0 N-CA-C 100.933 -3.729 . . . . 64.200000000000003 100.933 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.411 ' HB3' HD21 ' A' ' 84' ' ' ASN . 11.3 t70 . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 105.911 -1.885 . . . . 63.210000000000001 105.911 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.457 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 15.2 m120 88.98 100.62 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 126.301 1.841 . . . . 72.25 114.097 173.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.351 0.0 OUTLIER -110.47 -76.19 0.61 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 119.532 -0.867 . . . . 74.209999999999994 113.148 171.905 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -79.02 -31.52 44.7 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 103.973 -2.603 . . . . 75.120000000000005 103.973 168.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.457 ' HB3' ' HA ' ' A' ' 15' ' ' ASN . . . -50.61 -14.25 0.18 Allowed 'General case' 0 C--O 1.204 -1.335 0 CA-C-N 112.166 -2.288 . . . . 74.430000000000007 112.242 170.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -48.11 -21.96 0.56 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.487 0.715 . . . . 74.209999999999994 112.19 174.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.551 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 29.8 t70 -60.53 -30.17 69.58 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 122.336 1.065 . . . . 51.509999999999998 109.856 172.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.62 ' CE2' HD22 ' A' ' 24' ' ' LEU . 67.3 t80 -70.21 -21.54 63.01 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 115.53 -0.759 . . . . 64.420000000000002 110.004 177.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.445 ' HB2' ' O ' ' A' ' 19' ' ' ALA . 14.7 mm100 -68.19 -30.06 69.06 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.233 -0.655 . . . . 74.219999999999999 109.233 174.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.551 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 0.3 OUTLIER -69.1 -36.37 77.48 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.07 -1.085 . . . . 74.340000000000003 108.07 174.148 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.62 HD22 ' CE2' ' A' ' 21' ' ' TYR . 6.9 tt -68.32 -37.06 80.22 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.583 -0.735 . . . . 64.239999999999995 109.561 172.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.52 ' HE ' ' HG ' ' A' ' 80' ' ' LEU . 1.8 mpt_? -54.12 -49.08 70.0 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.761 0.424 . . . . 71.219999999999999 111.216 176.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -50.71 -60.85 2.63 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 124.814 1.321 . . . . 75.109999999999999 108.69 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -69.72 -28.13 65.56 Favored 'General case' 0 N--CA 1.417 -2.08 0 N-CA-C 113.17 0.804 . . . . 73.129999999999995 113.17 -177.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.53 -42.39 95.77 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 121.092 -1.005 . . . . 73.430000000000007 109.406 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 70.4 mt -68.8 -42.04 82.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.293 -0.867 . . . . 62.210000000000001 109.312 177.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -58.01 -52.33 65.96 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 124.718 1.207 . . . . 63.119999999999997 111.09 178.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -69.25 -29.01 66.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.665 0.987 . . . . 74.340000000000003 113.665 -170.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.402 ' HB2' ' HG ' ' A' ' 34' ' ' LEU . 16.8 mt -97.45 3.13 50.93 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 118.955 -1.098 . . . . 64.019999999999996 112.944 170.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.99 45.88 14.3 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 122.911 1.339 . . . . 60.119999999999997 108.229 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.402 ' HG ' ' HB2' ' A' ' 32' ' ' LEU . 57.3 mt -88.34 -176.36 5.33 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.331 -1.304 . . . . 63.520000000000003 109.066 -179.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.5 m -140.43 148.27 52.99 Favored Pre-proline 0 C--N 1.28 -2.426 0 N-CA-C 105.537 -2.023 . . . . 52.149999999999999 105.537 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -55.66 -28.47 66.04 Favored 'Trans proline' 0 N--CA 1.491 1.328 0 C-N-CA 122.196 1.931 . . . . 74.329999999999998 112.371 177.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -76.61 -10.85 59.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.212 -0.449 . . . . 72.200000000000003 111.117 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -102.46 -23.39 13.92 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.087 -0.708 . . . . 70.200000000000003 109.087 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.6 tp -138.7 98.72 3.63 Favored 'General case' 0 N--CA 1.418 -2.05 0 C-N-CA 119.994 -0.682 . . . . 71.129999999999995 112.73 -172.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.415 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 28.3 t-80 -106.8 166.38 10.63 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 105.027 -2.212 . . . . 72.049999999999997 105.027 169.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.625 ' HA ' ' HB3' ' A' ' 80' ' ' LEU 0.508 17.0 pt-20 -64.5 -13.7 53.54 Favored 'General case' 0 CA--C 1.555 1.154 0 N-CA-C 117.518 2.414 . . . . 74.450000000000003 117.518 -171.713 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.415 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -91.62 -6.11 52.77 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 120.807 -1.183 . . . . 61.140000000000001 109.661 -179.518 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -75.48 141.17 43.14 Favored 'General case' 0 C--O 1.261 1.694 0 CA-C-N 115.618 -0.719 . . . . 25.32 111.975 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 3.7 m-20 -77.11 118.92 20.13 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.262 -0.881 . . . . 52.509999999999998 112.577 -178.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.446 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 25.6 mt -79.07 -33.97 44.1 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 114.704 1.372 . . . . 52.25 114.704 -177.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.1 mm -69.27 -26.5 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-O 121.779 0.8 . . . . 44.310000000000002 109.477 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -85.16 -10.85 56.23 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.175 -0.92 . . . . 53.32 110.122 178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -86.39 -19.74 29.27 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 108.747 -0.834 . . . . 72.209999999999994 108.747 175.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.57 29.7 3.3 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 115.432 -0.804 . . . . 33.149999999999999 115.053 174.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.446 ' CD1' ' HB3' ' A' ' 45' ' ' LEU . 72.8 mt -73.35 108.43 6.22 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 117.694 0.747 . . . . 73.340000000000003 110.482 174.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -67.8 163.47 21.69 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.751 -1.203 . . . . 64.140000000000001 107.751 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -72.8 -14.61 61.56 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 115.875 1.805 . . . . 73.209999999999994 115.875 -173.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 46.3 mm -86.24 -36.78 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 C-N-CA 117.991 -1.484 . . . . 62.32 107.746 176.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' HE ' ' HB2' ' A' ' 54' ' ' ARG . 7.7 ttm180 -65.34 -29.26 69.97 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 107.899 -1.148 . . . . 75.129999999999995 107.899 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.745 ' HG ' HD11 ' A' ' 71' ' ' LEU . 14.7 tp -73.96 -52.74 11.88 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.291 -1.322 . . . . 74.400000000000006 108.76 176.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 46.5 ttm -72.55 -22.62 60.98 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 113.13 0.789 . . . . 74.209999999999994 113.13 -174.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -64.83 -28.79 69.8 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.664 -0.814 . . . . 71.049999999999997 109.486 176.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.573 ' CZ3' ' HG ' ' A' ' 24' ' ' LEU . 16.8 m95 -71.06 -33.71 70.52 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.702 -0.681 . . . . 74.109999999999999 111.434 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.1 tp -58.03 -37.55 74.57 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.501 0.667 . . . . 74.019999999999996 110.323 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -70.86 -44.27 66.75 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.942 -1.026 . . . . 73.409999999999997 109.808 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.53 ' CZ2' ' HB2' ' A' ' 24' ' ' LEU . 51.8 t90 -54.24 -53.69 50.13 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.588 1.155 . . . . 75.120000000000005 109.666 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.429 ' CD2' HD21 ' A' ' 69' ' ' LEU . 43.7 m-85 -54.17 -50.19 67.58 Favored 'General case' 0 CA--C 1.504 -0.796 0 CA-C-O 121.603 0.716 . . . . 74.25 112.275 -179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -77.32 -13.44 59.93 Favored 'General case' 0 C--N 1.297 -1.681 0 CA-C-N 115.584 -0.735 . . . . 64.409999999999997 112.465 -174.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.762 ' NZ ' ' HA ' ' A' ' 64' ' ' LYS . 0.1 OUTLIER -83.31 -41.06 18.7 Favored 'General case' 0 C--N 1.312 -1.055 0 O-C-N 121.729 -0.607 . . . . 71.239999999999995 111.891 171.241 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -78.21 -11.2 59.91 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.032 0.833 . . . . 63.539999999999999 112.427 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.04 40.19 3.84 Favored Glycine 0 C--O 1.245 0.811 0 C-N-CA 120.385 -0.912 . . . . 50.25 112.739 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -114.47 167.13 10.99 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 122.488 -0.419 . . . . 75.219999999999999 111.884 178.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 53.7 ttt180 -128.91 94.19 3.78 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.447 0.536 . . . . 71.120000000000005 112.447 -166.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.429 HD21 ' CD2' ' A' ' 62' ' ' PHE . 1.4 pt? -167.74 161.83 13.55 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 109.715 -0.476 . . . . 64.430000000000007 109.715 175.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.746 ' HB ' ' OE2' ' A' ' 73' ' ' GLU . 2.6 m -116.6 165.19 13.54 Favored 'General case' 0 N--CA 1.417 -2.118 0 N-CA-C 107.082 -1.451 . . . . 70.099999999999994 107.082 174.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.745 HD11 ' HG ' ' A' ' 55' ' ' LEU . 14.8 tp -79.89 -23.91 41.54 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 112.287 0.477 . . . . 72.109999999999999 112.287 -174.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -67.98 -25.32 65.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 64.150000000000006 110.681 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.746 ' OE2' ' HB ' ' A' ' 70' ' ' THR . 2.2 mp0 -75.54 -34.98 60.79 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.597 -1.183 . . . . 73.25 108.668 179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.724 HD12 HD12 ' A' ' 71' ' ' LEU . 56.8 mt -68.94 -17.44 63.95 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 113.018 -1.901 . . . . 75.109999999999999 112.133 -178.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -81.79 -41.44 21.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.502 -0.555 . . . . 54.219999999999999 109.502 173.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.4 -43.72 80.63 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.315 -0.857 . . . . 63.340000000000003 110.653 -176.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -123.82 84.99 53.93 Favored Pre-proline 0 N--CA 1.428 -1.527 0 N-CA-C 107.947 -1.131 . . . . 71.420000000000002 107.947 175.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 58.0 Cg_endo -90.98 85.4 0.33 Allowed 'Trans proline' 0 N--CA 1.415 -3.139 0 C-N-CA 120.601 0.868 . . . . 63.119999999999997 112.338 -175.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 p -141.41 145.92 35.93 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-N 115.155 -0.929 . . . . 62.020000000000003 108.644 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.625 ' HB3' ' HA ' ' A' ' 41' ' ' GLU . 45.5 tp -60.3 -25.08 65.48 Favored 'General case' 0 C--N 1.279 -2.489 0 O-C-N 123.973 0.796 . . . . 61.219999999999999 112.007 -178.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.44 -37.88 50.65 Favored 'General case' 0 C--O 1.213 -0.821 0 C-N-CA 122.717 0.407 . . . . 72.329999999999998 110.968 176.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.494 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -60.06 -47.63 85.05 Favored 'General case' 0 CA--C 1.507 -0.686 0 C-N-CA 121.438 -0.105 . . . . 63.310000000000002 110.877 -177.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.585 ' CD1' HD22 ' A' ' 74' ' ' LEU . 5.8 m0 -58.84 -41.23 86.44 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.33 -0.989 . . . . 71.310000000000002 108.33 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.411 HD21 ' HB3' ' A' ' 14' ' ' ASP . 46.2 t30 -64.77 -52.49 56.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.239 -1.346 . . . . 74.319999999999993 110.976 -178.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -59.77 -32.71 70.85 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.94 0.496 . . . . 63.43 111.436 -179.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 93.7 mt -68.89 -23.28 64.18 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.431 0.634 . . . . 64.329999999999998 111.26 177.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.457 ' HG3' ' O ' ' A' ' 83' ' ' TRP . 90.8 mtp -79.68 -34.37 40.31 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 122.091 -0.381 . . . . 51.299999999999997 109.986 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.409 HD12 ' HB2' ' A' ' 93' ' ' GLU . 3.1 mm? -70.07 -13.32 62.16 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 121.604 0.716 . . . . 71.140000000000001 109.667 172.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.5 m -86.56 0.54 54.14 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 121.347 0.594 . . . . 74.329999999999998 110.387 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -73.94 -41.83 61.46 Favored 'General case' 0 N--CA 1.425 -1.693 0 CA-C-O 121.072 0.463 . . . . 72.200000000000003 110.063 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 49.5 m -163.69 147.25 8.22 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 106.308 -1.738 . . . . 73.439999999999998 106.308 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -57.85 135.85 71.63 Favored 'Trans proline' 0 C--O 1.24 0.592 0 C-N-CA 122.255 1.97 . . . . 61.299999999999997 112.366 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.409 ' HB2' HD12 ' A' ' 88' ' ' LEU . 58.8 mt-10 . . . . . 0 N--CA 1.428 -1.536 0 N-CA-C 105.356 -2.091 . . . . 72.230000000000004 105.356 -179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.4 t70 . . . . . 0 CA--C 1.496 -1.121 0 N-CA-C 106.551 -1.648 . . . . 75.230000000000004 106.551 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.525 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 43.7 m-80 -150.64 117.78 5.97 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.624 0.577 . . . . 73.450000000000003 109.472 -178.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -82.71 15.31 2.69 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 112.462 0.541 . . . . 75.340000000000003 112.462 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -66.14 -20.56 66.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 107.959 -1.126 . . . . 54.310000000000002 107.959 172.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.4 -16.6 0.2 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.121 1.769 . . . . 53.140000000000001 112.604 174.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.57 -29.44 51.25 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 122.888 0.475 . . . . 64.140000000000001 110.318 173.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.444 ' O ' ' HH2' ' A' ' 61' ' ' TRP . 31.7 t70 -64.07 -40.97 97.44 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 109.029 -0.73 . . . . 74.510000000000005 109.029 175.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.534 ' CE1' HD22 ' A' ' 24' ' ' LEU . 90.9 t80 -60.32 -22.85 63.7 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.636 0.774 . . . . 73.340000000000003 111.168 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -70.93 -21.58 62.34 Favored 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 120.632 -0.427 . . . . 73.519999999999996 110.224 -178.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.612 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 67.5 mt-30 -75.4 -39.44 59.06 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.162 -1.051 . . . . 62.299999999999997 108.162 172.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.534 HD22 ' CE1' ' A' ' 21' ' ' TYR . 3.6 tt -59.95 -38.68 83.13 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 108.251 -1.018 . . . . 62.520000000000003 108.251 175.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.607 ' HD2' HD13 ' A' ' 80' ' ' LEU . 2.8 tpp180 -62.21 -47.83 82.71 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.052 -0.976 . . . . 72.5 110.14 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -51.69 -54.59 26.52 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.188 0.995 . . . . 72.019999999999996 110.169 179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.612 ' HD2' ' O ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -75.18 -18.59 60.14 Favored 'General case' 0 C--O 1.205 -1.257 0 C-N-CA 119.61 -0.836 . . . . 61.219999999999999 112.142 -177.749 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.36 -25.9 64.4 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.714 0.293 . . . . 63.299999999999997 110.492 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.415 ' CD1' HD12 ' A' ' 39' ' ' LEU . 20.4 mm -62.88 -44.32 99.5 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 107.945 -1.132 . . . . 70.200000000000003 107.945 174.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -77.42 -34.32 54.74 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.144 -0.935 . . . . 54.219999999999999 111.335 -177.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.576 ' CD ' ' HD2' ' A' ' 54' ' ' ARG . 7.8 tp10 -44.6 -53.99 6.57 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 126.133 1.773 . . . . 71.219999999999999 113.357 -175.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.0 mt -113.86 13.65 18.43 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 119.986 -0.686 . . . . 64.409999999999997 110.566 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 54.52 65.89 1.38 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 122.716 1.246 . . . . 74.129999999999995 108.648 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.8 mt -100.48 132.66 45.74 Favored 'General case' 0 N--CA 1.424 -1.739 0 CA-C-N 114.401 -1.272 . . . . 65.400000000000006 110.306 -173.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.3 m -72.12 145.72 88.95 Favored Pre-proline 0 C--N 1.296 -1.726 0 N-CA-C 106.082 -1.821 . . . . 44.310000000000002 106.082 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -49.96 -29.55 21.6 Favored 'Trans proline' 0 N--CA 1.488 1.181 0 C-N-CA 122.703 2.269 . . . . 73.540000000000006 113.419 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.3 -14.21 60.48 Favored 'General case' 0 C--O 1.216 -0.699 0 C-N-CA 122.735 0.414 . . . . 71.109999999999999 111.642 178.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 20.6 tp60 -104.98 -11.16 16.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.01 -0.737 . . . . 72.209999999999994 109.01 178.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.572 HD13 HD11 ' A' ' 80' ' ' LEU . 2.2 tm? -132.26 71.84 1.48 Allowed 'General case' 0 N--CA 1.432 -1.332 0 CA-C-O 122.21 1.005 . . . . 74.409999999999997 109.557 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' O ' HD12 ' A' ' 80' ' ' LEU . 42.5 t-80 -118.31 165.34 13.97 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 106.652 -1.61 . . . . 74.349999999999994 106.652 173.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' A' ' 81' ' ' ALA . 7.5 tp10 -44.04 -40.48 4.83 Favored 'General case' 0 CA--C 1.564 1.507 0 C-N-CA 125.064 1.345 . . . . 65.010000000000005 113.338 -173.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.79 -2.72 47.09 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.966 -0.458 . . . . 74.450000000000003 111.651 -172.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 79' ' ' THR . 17.2 m -69.69 138.25 52.78 Favored 'General case' 0 C--O 1.248 1.012 0 CA-C-O 121.324 0.583 . . . . 61.219999999999999 112.031 -174.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.565 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 45.1 t-20 -79.88 120.07 23.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.461 -0.791 . . . . 72.109999999999999 110.861 -177.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 mt -79.05 -29.46 43.49 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 114.348 1.24 . . . . 74.120000000000005 114.348 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.1 mm -74.13 -29.99 26.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.14 -1.059 . . . . 70.299999999999997 108.14 177.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -31.54 71.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.419 -1.264 . . . . 75.400000000000006 109.641 176.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.62 -19.41 52.71 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.506 -0.77 . . . . 53.240000000000002 110.579 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.09 31.1 6.36 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.924 -0.655 . . . . 63.350000000000001 113.806 177.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tp -75.85 114.62 14.67 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.754 -1.202 . . . . 73.450000000000003 107.754 177.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -79.72 172.84 13.24 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.46 -0.496 . . . . 74.310000000000002 109.875 -175.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 18.9 m -78.52 -15.76 58.23 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.419 1.266 . . . . 71.209999999999994 114.419 -176.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.586 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 49.6 mm -76.12 -40.32 36.91 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.556 0 N-CA-C 105.655 -1.979 . . . . 60.549999999999997 105.655 174.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.576 ' HD2' ' CD ' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -53.17 -50.77 63.92 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 107.909 -1.145 . . . . 64.299999999999997 107.909 176.377 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.445 ' HB2' ' HA ' ' A' ' 52' ' ' SER . 67.7 mt -53.46 -51.55 62.36 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 113.992 -1.458 . . . . 75.420000000000002 111.988 176.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.429 ' HG2' ' HA ' ' A' ' 53' ' ' ILE . 21.7 ptp -77.97 -18.19 56.29 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 113.179 0.807 . . . . 64.510000000000005 113.179 -177.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.586 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 49.5 mtm180 -64.36 -44.93 89.88 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 107.176 -1.416 . . . . 74.430000000000007 107.176 173.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.453 ' CE3' ' HG ' ' A' ' 24' ' ' LEU . 17.1 m95 -64.45 -30.4 71.44 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.307 -1.315 . . . . 72.430000000000007 112.268 179.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.9 tp -56.75 -37.06 70.51 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.808 0.814 . . . . 74.010000000000005 110.781 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -79.12 -23.23 44.18 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.286 -0.87 . . . . 75.5 110.649 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.51 ' CZ3' ' HB2' ' A' ' 24' ' ' LEU . 28.2 t90 -77.2 -30.59 54.82 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.717 -0.674 . . . . 72.219999999999999 109.352 -179.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.447 ' HB3' ' HB2' ' A' ' 67' ' ' TYR . 37.1 m-85 -69.68 -53.65 17.58 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-O 122.188 0.994 . . . . 74.329999999999998 108.609 174.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -62.43 -14.42 40.61 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 113.477 -1.692 . . . . 71.409999999999997 111.241 -174.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -50.94 -42.97 60.12 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.159 1.784 . . . . 73.010000000000005 111.035 173.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.491 ' HB2' ' CE1' ' A' ' 67' ' ' TYR . 3.1 m-20 -109.23 8.85 25.95 Favored 'General case' 0 CA--C 1.496 -1.107 0 N-CA-C 109.58 -0.526 . . . . 74.349999999999994 109.58 -177.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 91.07 8.93 64.25 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 120.447 -0.882 . . . . 75.019999999999996 112.657 -177.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' CE1' ' HB2' ' A' ' 65' ' ' ASN . 59.2 m-85 -67.05 151.35 47.79 Favored 'General case' 0 CA--C 1.479 -1.769 0 N-CA-C 109.161 -0.681 . . . . 71.409999999999997 109.161 178.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.5 mtp180 -143.6 129.79 19.76 Favored 'General case' 0 C--N 1.274 -2.708 0 N-CA-C 113.556 0.947 . . . . 64.319999999999993 113.556 -168.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.413 HD11 ' CE2' ' A' ' 62' ' ' PHE . 3.7 pp -166.28 163.06 17.66 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-N 113.631 -1.622 . . . . 63.509999999999998 107.714 174.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.1 p -100.74 142.77 31.75 Favored 'General case' 0 N--CA 1.409 -2.476 0 N-CA-C 106.629 -1.619 . . . . 73.109999999999999 106.629 173.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.628 HD12 HD12 ' A' ' 74' ' ' LEU . 15.2 tp -67.01 -24.71 66.05 Favored 'General case' 0 C--N 1.293 -1.878 0 CA-C-O 120.708 0.29 . . . . 71.530000000000001 111.629 -173.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -66.51 -18.65 65.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.795 0.331 . . . . 74.120000000000005 110.863 -177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -76.3 -29.4 57.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.767 0.794 . . . . 71.310000000000002 109.318 179.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.628 HD12 HD12 ' A' ' 71' ' ' LEU . 16.3 mt -77.31 -20.13 55.42 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.758 -1.11 . . . . 72.239999999999995 110.468 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -82.77 -37.98 23.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 74.540000000000006 109.387 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.04 -43.74 95.15 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.576 -0.738 . . . . 72.109999999999999 110.6 -177.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.62 84.4 63.46 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 107.829 -1.174 . . . . 64.030000000000001 107.829 174.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.565 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 56.7 Cg_endo -79.89 86.57 1.65 Allowed 'Trans proline' 0 N--CA 1.434 -2.017 0 C-N-CA 121.187 1.258 . . . . 70.040000000000006 112.237 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' A' ' 43' ' ' SER . 17.4 p -153.16 160.59 42.88 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 105.864 -1.902 . . . . 51.530000000000001 105.864 -179.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.607 HD13 ' HD2' ' A' ' 25' ' ' ARG . 64.2 mt -61.86 -44.63 96.43 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-O 121.585 0.707 . . . . 54.310000000000002 109.733 175.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.413 ' HA ' ' OE1' ' A' ' 41' ' ' GLU . . . -44.51 -44.17 8.44 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.22 -1.809 . . . . 61.219999999999999 113.281 -177.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.637 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -62.95 -49.14 75.91 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 120.908 -0.317 . . . . 61.200000000000003 111.438 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.553 ' CD1' HD22 ' A' ' 74' ' ' LEU . 1.7 m0 -61.4 -46.2 91.15 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.033 -1.099 . . . . 74.239999999999995 108.033 -175.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -57.65 -55.52 33.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.192 -1.367 . . . . 63.509999999999998 110.448 -179.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -61.77 -33.07 73.42 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 111.913 0.338 . . . . 73.140000000000001 111.913 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 95.1 mt -65.41 -28.8 69.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.838 0.352 . . . . 63.240000000000002 111.282 178.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 83' ' ' TRP . 76.3 mtp -80.88 -28.62 35.91 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 116.404 -0.362 . . . . 63.109999999999999 110.28 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 15' ' ' ASN . 7.4 mp -74.69 -30.96 61.74 Favored 'General case' 0 CA--C 1.502 -0.884 0 C-N-CA 119.498 -0.881 . . . . 70.019999999999996 110.362 174.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.1 m -78.77 -43.34 25.76 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.906 -0.588 . . . . 74.329999999999998 110.848 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -125.01 41.76 3.44 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 113.168 0.803 . . . . 73.409999999999997 113.168 -173.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.522 ' HB3' ' HD3' ' A' ' 92' ' ' PRO . 44.0 t -60.74 -52.14 74.66 Favored Pre-proline 0 C--N 1.284 -2.253 0 C-N-CA 118.741 -1.184 . . . . 72.019999999999996 110.006 168.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 91' ' ' SER . 39.6 Cg_endo -108.99 117.59 0.03 OUTLIER 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 121.785 1.657 . . . . 71.150000000000006 111.605 171.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 . . . . . 0 C--N 1.297 -1.692 0 N-CA-C 105.176 -2.157 . . . . 73.329999999999998 105.176 177.28 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 CA--C 1.507 -0.694 0 N-CA-C 105.48 -2.045 . . . . 73.120000000000005 105.48 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.502 ' OD1' ' HA ' ' A' ' 19' ' ' ALA . 23.8 t30 -168.29 24.33 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 118.415 0.552 . . . . 73.019999999999996 110.587 179.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.438 ' HB2' HD11 ' A' ' 88' ' ' LEU . 5.6 mpt_? -81.8 -77.57 0.22 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 117.734 -1.586 . . . . 72.319999999999993 109.736 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 62.7 m170 -79.74 -26.35 40.78 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 106.837 -1.542 . . . . 74.200000000000003 106.837 170.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.625 ' HA ' ' SD ' ' A' ' 87' ' ' MET . . . -63.4 -13.58 41.33 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.171 -2.286 . . . . 60.030000000000001 112.6 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.502 ' HA ' ' OD1' ' A' ' 15' ' ' ASN . . . -50.31 -33.4 19.99 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-O 120.969 0.414 . . . . 62.219999999999999 110.904 173.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -66.35 -44.72 82.45 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 108.134 -1.061 . . . . 73.420000000000002 108.134 174.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.589 ' HB2' ' SD ' ' A' ' 87' ' ' MET . 71.0 t80 -62.29 -22.82 66.33 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 114.649 -1.159 . . . . 71.049999999999997 110.805 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -63.16 -33.69 76.02 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.448 -0.575 . . . . 73.329999999999998 109.448 176.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.678 ' HA ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -74.03 -36.92 64.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 116.173 -0.467 . . . . 70.329999999999998 109.819 175.526 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.569 HD22 ' CE2' ' A' ' 21' ' ' TYR . 3.6 tt -63.2 -37.02 85.6 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.937 -0.764 . . . . 62.450000000000003 108.937 174.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.556 ' HD2' HD13 ' A' ' 80' ' ' LEU . 3.2 tpp180 -58.78 -52.25 66.51 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 123.792 0.837 . . . . 75.239999999999995 109.781 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -56.24 -47.14 79.1 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-N 115.376 -0.829 . . . . 63.229999999999997 109.37 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 14.9 mmp_? -61.62 -46.24 90.63 Favored 'General case' 0 C--O 1.198 -1.648 0 CA-C-N 115.026 -0.988 . . . . 74.040000000000006 110.151 179.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 1.2 tt -59.91 -38.8 83.37 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.585 0.754 . . . . 74.409999999999997 111.261 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.608 HG12 HD23 ' A' ' 39' ' ' LEU . 61.4 mt -59.82 -49.03 85.41 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-O 120.884 0.373 . . . . 70.109999999999999 110.164 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.406 ' H ' ' HG2' ' A' ' 30' ' ' GLN . 7.3 pt20 -77.75 -19.2 55.55 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 112.715 0.635 . . . . 73.150000000000006 112.715 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 11.3 tp10 -55.94 -53.11 60.86 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.687 1.195 . . . . 74.450000000000003 110.707 176.746 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.507 ' HB2' ' CD1' ' A' ' 34' ' ' LEU . 96.4 mt -97.32 -3.97 39.47 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 119.529 -0.868 . . . . 53.439999999999998 111.405 175.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 71.57 42.91 0.63 Allowed 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.845 0.858 . . . . 72.140000000000001 110.493 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.507 ' CD1' ' HB2' ' A' ' 32' ' ' LEU . 3.2 mp -83.1 -179.85 7.54 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 107.984 -1.117 . . . . 72.030000000000001 107.984 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.412 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 37.6 p -130.49 158.67 73.84 Favored Pre-proline 0 C--N 1.285 -2.207 0 N-CA-C 106.305 -1.739 . . . . 74.420000000000002 106.305 173.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -66.57 -1.65 6.09 Favored 'Trans proline' 0 N--CA 1.49 1.265 0 C-N-CA 121.969 1.779 . . . . 51.140000000000001 112.027 178.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -81.08 -22.02 39.53 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.849 -0.797 . . . . 63.100000000000001 108.849 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 35' ' ' THR . 11.5 pt20 -121.53 9.21 10.21 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.426 -0.806 . . . . 74.310000000000002 109.879 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.608 HD23 HG12 ' A' ' 29' ' ' ILE . 28.1 tp -142.83 105.66 4.52 Favored 'General case' 0 N--CA 1.425 -1.69 0 C-N-CA 119.644 -0.822 . . . . 72.319999999999993 112.083 -177.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.411 ' HD1' ' CD ' ' A' ' 42' ' ' GLU . 32.0 t-80 -131.1 167.37 19.23 Favored 'General case' 0 C--N 1.287 -2.151 0 C-N-CA 125.7 1.6 . . . . 75.239999999999995 107.201 176.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -42.19 -39.8 2.16 Favored 'General case' 0 CA--C 1.561 1.38 0 C-N-CA 124.617 1.167 . . . . 73.430000000000007 113.897 -177.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.411 ' CD ' ' HD1' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -89.47 -5.71 57.1 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.943 -0.473 . . . . 64.230000000000004 111.912 -171.62 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.417 ' O ' ' HA ' ' A' ' 79' ' ' THR . 16.5 m -68.78 128.79 37.92 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 121.264 0.554 . . . . 65.420000000000002 111.828 -175.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.543 ' HA ' ' O ' ' A' ' 78' ' ' PRO . 43.1 t-20 -74.4 116.02 14.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.442 -0.799 . . . . 51.450000000000003 110.315 -179.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.598 ' HB3' HD12 ' A' ' 50' ' ' LEU . 54.6 mt -79.11 -23.86 43.79 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 114.98 1.474 . . . . 74.099999999999994 114.98 -175.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.418 HG12 ' CB ' ' A' ' 78' ' ' PRO . 37.3 mm -75.87 -35.55 30.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 N-CA-C 108.757 -0.831 . . . . 73.409999999999997 108.757 178.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -76.83 -15.5 59.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.296 -0.865 . . . . 72.019999999999996 110.162 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.15 -21.32 46.65 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.835 -0.802 . . . . 72.140000000000001 108.835 175.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.97 25.58 5.58 Favored Glycine 0 N--CA 1.43 -1.76 0 N-CA-C 115.112 0.805 . . . . 63.43 115.112 174.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.598 HD12 ' HB3' ' A' ' 45' ' ' LEU . 65.3 mt -73.25 109.24 6.62 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 118.168 0.984 . . . . 73.439999999999998 110.154 174.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.433 ' OD1' ' HD3' ' A' ' 54' ' ' ARG . 3.0 p30 -71.97 169.64 15.49 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.253 -1.017 . . . . 75.549999999999997 108.253 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 56' ' ' MET . 28.3 m -74.11 -14.61 61.0 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 115.104 1.52 . . . . 50.049999999999997 115.104 -172.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.402 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 45.5 mm -78.17 -38.44 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.164 0 C-N-CA 117.62 -1.632 . . . . 73.319999999999993 107.891 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HD3' ' OD1' ' A' ' 51' ' ' ASP . 4.8 mmm-85 -58.42 -46.23 86.89 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 106.172 -1.788 . . . . 73.409999999999997 106.172 177.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.51 ' HG ' HD11 ' A' ' 71' ' ' LEU . 12.3 tp -59.96 -47.23 86.64 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.008 -1.906 . . . . 62.340000000000003 111.438 -177.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 52' ' ' SER . 19.9 ptp -83.55 -18.55 37.97 Favored 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 120.046 -0.662 . . . . 74.430000000000007 112.022 -176.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 36.8 mtm105 -63.4 -36.99 85.55 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 108.696 -0.853 . . . . 73.420000000000002 108.696 172.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.44 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 10.8 m95 -65.7 -32.25 73.71 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.508 -1.224 . . . . 74.519999999999996 112.54 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 54.2 tp -58.13 -31.49 67.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.488 0.661 . . . . 73.109999999999999 110.959 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 42.7 t-80 -81.65 -30.99 32.54 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.186 -0.461 . . . . 74.109999999999999 109.936 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.613 ' O ' ' HG3' ' A' ' 64' ' ' LYS . 23.7 t90 -70.1 -33.0 71.32 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.725 -0.67 . . . . 72.140000000000001 111.129 -175.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.454 ' O ' ' HB2' ' A' ' 67' ' ' TYR . 72.4 m-85 -64.54 -47.78 77.52 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 122.108 0.956 . . . . 71.030000000000001 110.906 177.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.527 ' HA ' ' O ' ' A' ' 67' ' ' TYR . 58.6 mtm180 -64.59 -13.19 52.06 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 115.479 1.659 . . . . 72.109999999999999 115.479 -169.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.613 ' HG3' ' O ' ' A' ' 61' ' ' TRP . 18.8 mtmm -52.52 -45.67 66.37 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 121.639 0.733 . . . . 73.230000000000004 110.561 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -95.82 11.28 34.19 Favored 'General case' 0 CA--C 1.5 -0.949 0 CA-C-N 115.056 -0.974 . . . . 71.310000000000002 110.571 -171.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 87.68 8.87 72.73 Favored Glycine 0 N--CA 1.429 -1.773 0 C-N-CA 120.155 -1.021 . . . . 54.140000000000001 111.195 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.527 ' O ' ' HA ' ' A' ' 63' ' ' ARG . 23.4 m-85 -74.75 158.61 33.23 Favored 'General case' 0 CA--C 1.473 -2.016 0 N-CA-C 109.001 -0.74 . . . . 70.400000000000006 109.001 176.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.626 ' NH2' ' HB2' ' A' ' 93' ' ' GLU . 10.6 ptm180 -155.14 135.78 13.48 Favored 'General case' 0 C--N 1.257 -3.452 0 CA-C-N 114.99 -1.005 . . . . 74.219999999999999 110.999 -167.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -167.95 163.91 13.8 Favored 'General case' 0 C--N 1.29 -2.011 0 O-C-N 124.444 1.09 . . . . 74.219999999999999 108.341 171.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 62.0 p -101.73 142.33 33.23 Favored 'General case' 0 N--CA 1.412 -2.334 0 N-CA-C 107.505 -1.294 . . . . 62.109999999999999 107.505 173.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.52 HD12 HD12 ' A' ' 74' ' ' LEU . 15.1 tp -64.58 -24.49 67.62 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.748 0.785 . . . . 73.340000000000003 109.826 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.402 ' HE ' ' HB3' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -51.58 -27.5 11.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.622 1.569 . . . . 74.319999999999993 110.4 174.483 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -85.3 -28.27 25.39 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.954 -0.566 . . . . 74.340000000000003 110.457 -177.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.52 HD12 HD12 ' A' ' 71' ' ' LEU . 15.9 mt -78.32 -22.91 47.39 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.547 -0.751 . . . . 74.219999999999999 110.238 -178.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -78.85 -38.27 38.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.993 -0.549 . . . . 73.120000000000005 109.644 172.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.69 84.44 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.587 -0.733 . . . . 73.209999999999994 110.816 -178.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.44 86.11 58.92 Favored Pre-proline 0 N--CA 1.43 -1.428 0 N-CA-C 109.028 -0.73 . . . . 72.310000000000002 109.028 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.543 ' O ' ' HA ' ' A' ' 44' ' ' ASN . 40.9 Cg_endo -86.78 86.43 0.81 Allowed 'Trans proline' 0 N--CA 1.425 -2.538 0 C-N-CA 121.041 1.161 . . . . 71.129999999999995 112.45 -176.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' A' ' 43' ' ' SER . 15.3 p -152.84 152.32 31.43 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 105.618 -1.993 . . . . 63.310000000000002 105.618 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.563 HD11 ' HG ' ' A' ' 39' ' ' LEU . 43.4 mt -54.67 -47.25 73.82 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 118.637 0.653 . . . . 71.129999999999995 111.255 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.09 -40.43 23.26 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 114.207 -1.361 . . . . 75.319999999999993 112.778 -177.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.458 ' O ' ' HG ' ' A' ' 86' ' ' LEU . . . -65.42 -49.55 68.77 Favored 'General case' 0 C--O 1.208 -1.123 0 O-C-N 123.479 0.487 . . . . 63.310000000000002 111.753 -178.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.48 ' CD1' HD22 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -66.01 -38.3 88.12 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 106.993 -1.484 . . . . 73.409999999999997 106.993 -176.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -57.41 -51.47 69.28 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.199 -1.819 . . . . 70.129999999999995 111.276 176.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -73.34 -31.24 63.85 Favored 'General case' 0 CA--C 1.504 -0.798 0 CA-C-N 116.413 -0.358 . . . . 74.109999999999999 111.117 -179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 82' ' ' ALA . 78.7 mt -60.26 -38.9 84.94 Favored 'General case' 0 C--O 1.19 -2.048 0 N-CA-C 113.246 0.832 . . . . 74.420000000000002 113.246 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.625 ' SD ' ' HA ' ' A' ' 18' ' ' ALA 0.264 16.7 ptp -67.84 -35.23 78.21 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 117.86 -1.536 . . . . 72.25 112.305 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.438 HD11 ' HB2' ' A' ' 16' ' ' ARG . 4.5 mm? -68.16 -46.04 71.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 120.428 -0.509 . . . . 73.150000000000006 111.927 171.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 34.6 t -70.88 -27.02 63.5 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 111.962 0.356 . . . . 50.210000000000001 111.962 -177.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 -103.89 21.24 16.67 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.852 -0.158 . . . . 63.530000000000001 110.791 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 71.1 m -61.62 123.53 77.25 Favored Pre-proline 0 N--CA 1.44 -0.927 0 N-CA-C 106.676 -1.602 . . . . 71.239999999999995 106.676 172.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -7.4 116.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.375 1.955 1 C-N-CA 126.753 4.969 . . . . 55.450000000000003 118.417 -163.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.626 ' HB2' ' NH2' ' A' ' 68' ' ' ARG . 11.0 mt-10 . . . . . 0 N--CA 1.44 -0.963 0 N-CA-C 104.367 -2.457 . . . . 63.340000000000003 104.367 179.411 . . . . . . . . 1 1 . 1 stop_ save_